6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide

C12H23N3O — CID 62370528

IUPAC6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1CC1CCNC1
InChIInChI=1S/C12H23N3O/c1-9-2-3-11(12(13)16)8-15(9)7-10-4-5-14-6-10/h9-11,14H,2-8H2,1H3,(H2,13,16)
InChIKeyLVUJZYXEWSRXGL-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.18
Rot. Bonds3

About 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide

6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide (PubChem CID 62370528) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide
PubChem CID62370528
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1CC1CCNC1
InChIInChI=1S/C12H23N3O/c1-9-2-3-11(12(13)16)8-15(9)7-10-4-5-14-6-10/h9-11,14H,2-8H2,1H3,(H2,13,16)
InChIKeyLVUJZYXEWSRXGL-UHFFFAOYSA-N
XLogP0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-1-[[(2S)-pyrrolidin-2-yl]methyl]piperidine-3-carboxamide
CID 104870094
6-methyl-1-pyrrolidin-3-ylpiperidine-3-carboxamide
CID 62327751
(3S,6R)-6-methyl-1-[(3R)-pyrrolidine-3-carbonyl]piperidine-3-carboxamide
CID 94916502
1-[(4-hydroxypiperidin-4-yl)methyl]-6-methylpiperidine-3-carboxamide
CID 62222385
2-methyl-1-(pyrrolidin-3-ylmethyl)piperidine;dihydrochloride
CID 56831717
(3R,6S)-6-methyl-1-(3-methylbut-2-enyl)piperidine-3-carboxamide
CID 95292502
N-(2-methoxyethyl)-6-methyl-1-(piperidin-4-ylmethyl)piperidine-3-carboxamide
CID 119930805
1-(3-amino-2-hydroxypropyl)-6-methylpiperidine-3-carboxamide
CID 104643418
1-(2,3-dihydroxypropyl)-6-methylpiperidine-3-carboxamide
CID 82849638
1-(2-bromo-3,3,3-trifluoropropyl)-6-methylpiperidine-3-carboxamide
CID 64758750
6-methyl-1-(3-pyrrolidin-2-ylpropyl)piperidine-3-carboxamide
CID 55076612
6-methyl-1-[(4-methylcyclohexyl)methyl]piperidine-3-carboxylic acid
CID 122084180

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide (CID 62370528) is 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide is CC1CCC(C(N)=O)CN1CC1CCNC1.
What is the InChIKey of 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide?
The InChIKey is LVUJZYXEWSRXGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-9-2-3-11(12(13)16)8-15(9)7-10-4-5-14-6-10/h9-11,14H,2-8H2,1H3,(H2,13,16).
What are the key properties of 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide?
6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide has a molecular weight of 225.34 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-(pyrrolidin-3-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 62370528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).