N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide

C15H31N3O — CID 106640901

IUPACN-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide
SMILESCCCN(CC(=O)N(C)C(C)C)CC1CCCNC1
InChIInChI=1S/C15H31N3O/c1-5-9-18(11-14-7-6-8-16-10-14)12-15(19)17(4)13(2)3/h13-14,16H,5-12H2,1-4H3
InChIKeyAIQSGRXYRMJLCJ-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.56
Rot. Bonds7

About N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide

N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide (PubChem CID 106640901) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide
PubChem CID106640901
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide
SMILESCCCN(CC(=O)N(C)C(C)C)CC1CCCNC1
InChIInChI=1S/C15H31N3O/c1-5-9-18(11-14-7-6-8-16-10-14)12-15(19)17(4)13(2)3/h13-14,16H,5-12H2,1-4H3
InChIKeyAIQSGRXYRMJLCJ-UHFFFAOYSA-N
XLogP1.56
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
CID 106640806
N'-acetyl-2-[piperidin-3-ylmethyl(propyl)amino]acetohydrazide
CID 106640655
2-[piperidin-3-ylmethyl(propyl)amino]-1-pyrrolidin-1-ylethanone
CID 106640711
3-[piperidin-3-ylmethyl(propyl)amino]propan-1-ol
CID 106640793
1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one
CID 106640737
2-[methyl(piperidin-3-ylmethyl)amino]-N-propylpropanamide
CID 106636555
ethyl N-(piperidin-3-ylmethyl)-N-propylcarbamate
CID 106630010
4-[piperidin-3-ylmethyl(propyl)amino]butanenitrile
CID 106640658
N-(2-methylsulfanylethyl)-N-(piperidin-3-ylmethyl)propan-1-amine
CID 106640432
2-[methyl(piperidin-3-ylmethyl)amino]-N-pentan-2-ylpropanamide
CID 106636671
2-(dimethylamino)-N-methyl-N-(piperidin-3-ylmethyl)acetamide
CID 106627954
2-[azetidin-3-yl(propyl)amino]-N-methyl-N-propan-2-ylacetamide
CID 66214520

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide?
The IUPAC name of N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide (CID 106640901) is N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide is CCCN(CC(=O)N(C)C(C)C)CC1CCCNC1.
What is the InChIKey of N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide?
The InChIKey is AIQSGRXYRMJLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-9-18(11-14-7-6-8-16-10-14)12-15(19)17(4)13(2)3/h13-14,16H,5-12H2,1-4H3.
What are the key properties of N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide?
N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide has a molecular weight of 269.43 g/mol, XLogP of 1.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 106640901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).