3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid

C102H222N14O10 — CID 158076137

IUPAC3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid
SMILESC.C.C.C.C.C.C.C.C.CCCN1CC(C)CC(C)C1.CCCN1CCC(C(=O)O)CC1.CCCN1CCCC(C(=O)N(C)C)C1.CCCN1CCCC(C(=O)N(C)CCC)C1.CCCN1CCCC(C(=O)N(C)CCOC)C1.CCCN1CCCC(C(=O)NCC)C1.CCCN1CCCC(C(=O)O)C1.CCCN1CCCC(C(N)=O)C1.CCCN1CCCCC1
InChIInChI=1S/C13H26N2O2.C13H26N2O.2C11H22N2O.C10H21N.C9H18N2O.2C9H17NO2.C8H17N.9CH4/c1-4-7-15-8-5-6-12(11-15)13(16)14(2)9-10-17-3;1-4-8-14(3)13(16)12-7-6-10-15(11-12)9-5-2;1-4-7-13-8-5-6-10(9-13)11(14)12(2)3;1-3-7-13-8-5-6-10(9-13)11(14)12-4-2;1-4-5-11-7-9(2)6-10(3)8-11;1-2-5-11-6-3-4-8(7-11)9(10)12;1-2-5-10-6-3-8(4-7-10)9(11)12;1-2-5-10-6-3-4-8(7-10)9(11)12;1-2-6-9-7-4-3-5-8-9;;;;;;;;;/h12H,4-11H2,1-3H3;12H,4-11H2,1-3H3;10H,4-9H2,1-3H3;10H,3-9H2,1-2H3,(H,12,14);9-10H,4-8H2,1-3H3;8H,2-7H2,1H3,(H2,10,12);2*8H,2-7H2,1H3,(H,11,12);2-8H2,1H3;9*1H4
InChIKeyFMJWSONOEOJHAV-UHFFFAOYSA-N
MW1804.99 g/mol
LogP18.59
Rot. Bonds31

About 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid

3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid (PubChem CID 158076137) has the molecular formula C102H222N14O10 and a molecular weight of 1804.99 g/mol. Its IUPAC name is 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid
PubChem CID158076137
Molecular FormulaC102H222N14O10
Molecular Weight1804.99 g/mol
Exact Mass1803.73
IUPAC Name3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid
SMILESC.C.C.C.C.C.C.C.C.CCCN1CC(C)CC(C)C1.CCCN1CCC(C(=O)O)CC1.CCCN1CCCC(C(=O)N(C)C)C1.CCCN1CCCC(C(=O)N(C)CCC)C1.CCCN1CCCC(C(=O)N(C)CCOC)C1.CCCN1CCCC(C(=O)NCC)C1.CCCN1CCCC(C(=O)O)C1.CCCN1CCCC(C(N)=O)C1.CCCN1CCCCC1
InChIInChI=1S/C13H26N2O2.C13H26N2O.2C11H22N2O.C10H21N.C9H18N2O.2C9H17NO2.C8H17N.9CH4/c1-4-7-15-8-5-6-12(11-15)13(16)14(2)9-10-17-3;1-4-8-14(3)13(16)12-7-6-10-15(11-12)9-5-2;1-4-7-13-8-5-6-10(9-13)11(14)12(2)3;1-3-7-13-8-5-6-10(9-13)11(14)12-4-2;1-4-5-11-7-9(2)6-10(3)8-11;1-2-5-11-6-3-4-8(7-11)9(10)12;1-2-5-10-6-3-8(4-7-10)9(11)12;1-2-5-10-6-3-4-8(7-10)9(11)12;1-2-6-9-7-4-3-5-8-9;;;;;;;;;/h12H,4-11H2,1-3H3;12H,4-11H2,1-3H3;10H,4-9H2,1-3H3;10H,3-9H2,1-2H3,(H,12,14);9-10H,4-8H2,1-3H3;8H,2-7H2,1H3,(H2,10,12);2*8H,2-7H2,1H3,(H,11,12);2-8H2,1H3;9*1H4
InChIKeyFMJWSONOEOJHAV-UHFFFAOYSA-N
XLogP18.59
TPSA246.11 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds31
Heavy Atoms126
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001804.99
LogP ≤ 518.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid?
The IUPAC name of 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid (CID 158076137) is 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid.
What is the SMILES notation for 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid?
The canonical SMILES for 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid is C.C.C.C.C.C.C.C.C.CCCN1CC(C)CC(C)C1.CCCN1CCC(C(=O)O)CC1.CCCN1CCCC(C(=O)N(C)C)C1.CCCN1CCCC(C(=O)N(C)CCC)C1.CCCN1CCCC(C(=O)N(C)CCOC)C1.CCCN1CCCC(C(=O)NCC)C1.CCCN1CCCC(C(=O)O)C1.CCCN1CCCC(C(N)=O)C1.CCCN1CCCCC1.
What is the InChIKey of 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid?
The InChIKey is FMJWSONOEOJHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.C13H26N2O.2C11H22N2O.C10H21N.C9H18N2O.2C9H17NO2.C8H17N.9CH4/c1-4-7-15-8-5-6-12(11-15)13(16)14(2)9-10-17-3;1-4-8-14(3)13(16)12-7-6-10-15(11-12)9-5-2;1-4-7-13-8-5-6-10(9-13)11(14)12(2)3;1-3-7-13-8-5-6-10(9-13)11(14)12-4-2;1-4-5-11-7-9(2)6-10(3)8-11;1-2-5-11-6-3-4-8(7-11)9(10)12;1-2-5-10-6-3-8(4-7-10)9(11)12;1-2-5-10-6-3-4-8(7-10)9(11)12;1-2-6-9-7-4-3-5-8-9;;;;;;;;;/h12H,4-11H2,1-3H3;12H,4-11H2,1-3H3;10H,4-9H2,1-3H3;10H,3-9H2,1-2H3,(H,12,14);9-10H,4-8H2,1-3H3;8H,2-7H2,1H3,(H2,10,12);2*8H,2-7H2,1H3,(H,11,12);2-8H2,1H3;9*1H4.
What are the key properties of 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid?
3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid has a molecular weight of 1804.99 g/mol, XLogP of 18.59, 31 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-propylpiperidine;N,N-dimethyl-1-propylpiperidine-3-carboxamide;N-ethyl-1-propylpiperidine-3-carboxamide;methane;N-(2-methoxyethyl)-N-methyl-1-propylpiperidine-3-carboxamide;N-methyl-N,1-dipropylpiperidine-3-carboxamide;1-propylpiperidine;1-propylpiperidine-3-carboxamide;1-propylpiperidine-3-carboxylic acid;1-propylpiperidine-4-carboxylic acid is sourced from PubChem (CID 158076137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).