6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide

C13H23N3O2 — CID 61366636

IUPAC6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)CC1CCCN1
InChIInChI=1S/C13H23N3O2/c1-9-4-5-10(13(14)18)8-16(9)12(17)7-11-3-2-6-15-11/h9-11,15H,2-8H2,1H3,(H2,14,18)
InChIKeyAKKQYLRPTXXZDF-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.24
Rot. Bonds3

About 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide

6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide (PubChem CID 61366636) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide
PubChem CID61366636
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)CC1CCCN1
InChIInChI=1S/C13H23N3O2/c1-9-4-5-10(13(14)18)8-16(9)12(17)7-11-3-2-6-15-11/h9-11,15H,2-8H2,1H3,(H2,14,18)
InChIKeyAKKQYLRPTXXZDF-UHFFFAOYSA-N
XLogP0.24
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-1-(2-thiomorpholin-3-ylacetyl)piperidine-3-carboxamide;hydrochloride
CID 119936929
6-methyl-1-[[(2S)-pyrrolidin-2-yl]methyl]piperidine-3-carboxamide
CID 104870094
1-(2-methylpiperidin-1-yl)-2-piperidin-2-ylethanone
CID 43151335
6-methyl-1-(3-pyrrolidin-2-ylpropyl)piperidine-3-carboxamide
CID 55076612
1-(2-pyrrolidin-2-ylacetyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119726913
6-methyl-1-(2-piperazin-1-ylacetyl)piperidine-3-carboxamide
CID 54944945
1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride
CID 119291566
1-(4-hydroxybutanoyl)-6-methylpiperidine-3-carboxamide
CID 79201154
1-(2-methyl-4-phenylpyrrolidin-1-yl)-2-pyrrolidin-2-ylethanone
CID 119790957
1-(2,3-dimethylpiperidin-1-yl)-2-pyrrolidin-2-ylethanone
CID 62122858
1-(5-chloropentanoyl)-6-methylpiperidine-3-carboxamide
CID 54875909
ethyl 5-carbamoyl-2-methylpiperidine-1-carboxylate
CID 61067923

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide?
The IUPAC name of 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide (CID 61366636) is 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide.
What is the SMILES notation for 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide?
The canonical SMILES for 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide is CC1CCC(C(N)=O)CN1C(=O)CC1CCCN1.
What is the InChIKey of 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide?
The InChIKey is AKKQYLRPTXXZDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-9-4-5-10(13(14)18)8-16(9)12(17)7-11-3-2-6-15-11/h9-11,15H,2-8H2,1H3,(H2,14,18).
What are the key properties of 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide?
6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide has a molecular weight of 253.35 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-3-carboxamide is sourced from PubChem (CID 61366636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).