3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide

C15H29N3O — CID 107067190

IUPAC3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)NCCCN1CCCCC1
InChIInChI=1S/C15H29N3O/c1-13-7-5-8-16-14(13)15(19)17-9-6-12-18-10-3-2-4-11-18/h13-14,16H,2-12H2,1H3,(H,17,19)
InChIKeyYNKTUYCBKRVPPV-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.37
Rot. Bonds5

About 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide

3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide (PubChem CID 107067190) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide
PubChem CID107067190
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)NCCCN1CCCCC1
InChIInChI=1S/C15H29N3O/c1-13-7-5-8-16-14(13)15(19)17-9-6-12-18-10-3-2-4-11-18/h13-14,16H,2-12H2,1H3,(H,17,19)
InChIKeyYNKTUYCBKRVPPV-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(3R)-N-(3-piperidin-1-ylpropyl)piperidine-3-carboxamide
CID 81123639
5-[(3-methylpiperidine-2-carbonyl)amino]pentanoic acid
CID 107068216
N-[3-(dimethylamino)propyl]-3-methylpiperidine-2-carboxamide
CID 62338925
N-[3-(azepan-1-yl)propyl]piperidine-3-carboxamide;dihydrochloride
CID 119831193
ethane;molecular hydrogen;N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide
CID 142349997
N-[3-(azepan-1-yl)propyl]pyrrolidine-3-carboxamide
CID 119831281
(3R)-N-(3-piperidin-1-ylpropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 67293748
N-(3-piperidin-1-ylpropyl)pyrrolidine-3-carboxamide;dihydrochloride
CID 119835547
(3S)-1-methyl-N-(3-pyrrolidin-1-ylpropyl)piperidine-3-carboxamide
CID 95903528
3-(3-piperidin-1-ylpropylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103549965
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)acetamide;dihydrochloride
CID 119835586
2-hydroxy-4-[(3-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 107835996

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide?
The IUPAC name of 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide (CID 107067190) is 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide is CC1CCCNC1C(=O)NCCCN1CCCCC1.
What is the InChIKey of 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide?
The InChIKey is YNKTUYCBKRVPPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-13-7-5-8-16-14(13)15(19)17-9-6-12-18-10-3-2-4-11-18/h13-14,16H,2-12H2,1H3,(H,17,19).
What are the key properties of 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide?
3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-piperidin-1-ylpropyl)piperidine-2-carboxamide is sourced from PubChem (CID 107067190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).