N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide

C16H29N3O2 — CID 119783440

IUPACN-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(C(=O)CC(C)C2CCNCC2)C1
InChIInChI=1S/C16H29N3O2/c1-12(13-5-7-18-8-6-13)10-15(20)19-9-3-4-14(11-19)16(21)17-2/h12-14,18H,3-11H2,1-2H3,(H,17,21)
InChIKeyCKQMPTLUDHISNE-UHFFFAOYSA-N
MW295.43 g/mol
LogP1.00
Rot. Bonds4

About N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide

N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide (PubChem CID 119783440) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide
PubChem CID119783440
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC NameN-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(C(=O)CC(C)C2CCNCC2)C1
InChIInChI=1S/C16H29N3O2/c1-12(13-5-7-18-8-6-13)10-15(20)19-9-3-4-14(11-19)16(21)17-2/h12-14,18H,3-11H2,1-2H3,(H,17,21)
InChIKeyCKQMPTLUDHISNE-UHFFFAOYSA-N
XLogP1.00
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-piperidin-4-yl-1-pyrrolidin-1-ylbutan-1-one;hydrochloride
CID 119669978
1-[3-(azepan-1-ylmethyl)piperidin-1-yl]-3-piperidin-4-ylbutan-1-one;dihydrochloride
CID 119875753
1-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-3-piperidin-4-ylbutan-1-one
CID 119837290
1-(4-ethylazepan-1-yl)-3-piperidin-4-ylbutan-1-one
CID 119794906
1-[3-(methoxymethyl)piperidin-1-yl]-3-piperidin-4-ylbutan-1-one;hydrochloride
CID 119781766
1-[3-(ethoxymethyl)piperidin-1-yl]-3-piperidin-4-ylbutan-1-one
CID 119786521
3-piperidin-4-yl-1-[4-(2-pyrrolidin-1-ylacetyl)piperazin-1-yl]butan-1-one
CID 119876029
1-[3-(aminomethyl)pentanoyl]-N-methylpiperidine-3-carboxamide
CID 103195301
N-butyl-1-(3-piperidin-3-ylbutanoyl)piperidine-3-carboxamide;hydrochloride
CID 119762851
1-(4-aminopentanoyl)-N-methylpiperidine-3-carboxamide;hydrochloride
CID 120562628
1-[2-(tert-butylamino)acetyl]-N-methylpiperidine-3-carboxamide
CID 113234306
1-[2-(cyclopropylmethylamino)acetyl]-N-methylpiperidine-3-carboxamide
CID 113266805

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide (CID 119783440) is N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide is CNC(=O)C1CCCN(C(=O)CC(C)C2CCNCC2)C1.
What is the InChIKey of N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide?
The InChIKey is CKQMPTLUDHISNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-12(13-5-7-18-8-6-13)10-15(20)19-9-3-4-14(11-19)16(21)17-2/h12-14,18H,3-11H2,1-2H3,(H,17,21).
What are the key properties of N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide?
N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide has a molecular weight of 295.43 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-piperidin-4-ylbutanoyl)piperidine-3-carboxamide is sourced from PubChem (CID 119783440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).