2,4-dimethyl-N-propylpiperidine-1-carboxamide

C11H22N2O — CID 115644943

IUPAC2,4-dimethyl-N-propylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCC(C)CC1C
InChIInChI=1S/C11H22N2O/c1-4-6-12-11(14)13-7-5-9(2)8-10(13)3/h9-10H,4-8H2,1-3H3,(H,12,14)
InChIKeyVZGGRODICYUNGY-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.23
Rot. Bonds2

About 2,4-dimethyl-N-propylpiperidine-1-carboxamide

2,4-dimethyl-N-propylpiperidine-1-carboxamide (PubChem CID 115644943) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2,4-dimethyl-N-propylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-propylpiperidine-1-carboxamide
PubChem CID115644943
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2,4-dimethyl-N-propylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCC(C)CC1C
InChIInChI=1S/C11H22N2O/c1-4-6-12-11(14)13-7-5-9(2)8-10(13)3/h9-10H,4-8H2,1-3H3,(H,12,14)
InChIKeyVZGGRODICYUNGY-UHFFFAOYSA-N
XLogP2.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methyl-1-(propylcarbamoyl)piperidine-2-carboxylic acid
CID 114422022
6-[(2,4-dimethylpiperidine-1-carbonyl)amino]hexanoic acid
CID 62331104
ethyl 2-[(2,4-dimethylpiperidine-1-carbonyl)amino]acetate
CID 55061328
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
4-amino-N-butyl-2-methylpiperidine-1-carboxamide
CID 115312277
4-methyl-1-(pentylcarbamoyl)piperidine-2-carboxylic acid
CID 114425136
(2S)-2-[(2,4-dimethylpiperidine-1-carbonyl)amino]pentanoic acid
CID 107566820
4-[(2,4-dimethylpiperidine-1-carbonyl)amino]-4-oxobutanoic acid
CID 62331638
(2S)-2-[(2,4-dimethylpiperidine-1-carbonyl)amino]hexanoic acid
CID 107145998
N-(2-aminoethyl)-2-(2,4-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 62330298
methyl 2,4-dimethylpiperidine-1-carboxylate
CID 115643665
methyl (2S,4R)-2,4-dimethylpiperidine-1-carboxylate
CID 145048176

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-propylpiperidine-1-carboxamide?
The IUPAC name of 2,4-dimethyl-N-propylpiperidine-1-carboxamide (CID 115644943) is 2,4-dimethyl-N-propylpiperidine-1-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-propylpiperidine-1-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-propylpiperidine-1-carboxamide is CCCNC(=O)N1CCC(C)CC1C.
What is the InChIKey of 2,4-dimethyl-N-propylpiperidine-1-carboxamide?
The InChIKey is VZGGRODICYUNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-6-12-11(14)13-7-5-9(2)8-10(13)3/h9-10H,4-8H2,1-3H3,(H,12,14).
What are the key properties of 2,4-dimethyl-N-propylpiperidine-1-carboxamide?
2,4-dimethyl-N-propylpiperidine-1-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-propylpiperidine-1-carboxamide is sourced from PubChem (CID 115644943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).