4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide

C11H21N3O — CID 61059386

IUPAC4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(CN2CCCC2)CC1
InChIInChI=1S/C11H21N3O/c12-11(15)14-7-3-10(4-8-14)9-13-5-1-2-6-13/h10H,1-9H2,(H2,12,15)
InChIKeyWRVULMHTEUNIKT-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.87
Rot. Bonds2

About 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide

4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide (PubChem CID 61059386) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide
PubChem CID61059386
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(CN2CCCC2)CC1
InChIInChI=1S/C11H21N3O/c12-11(15)14-7-3-10(4-8-14)9-13-5-1-2-6-13/h10H,1-9H2,(H2,12,15)
InChIKeyWRVULMHTEUNIKT-UHFFFAOYSA-N
XLogP0.87
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-[4-(pyrrolidin-1-ylmethyl)azepan-1-yl]methanone
CID 91919810
3-amino-2-methyl-1-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one
CID 62668546
1-[4-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]cyclopropane-1-carbothioamide
CID 80590036
2-amino-3-methyl-1-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-1-one;dihydrochloride
CID 119851877
2-bromo-2-methyl-1-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one
CID 114328312
2,2-dimethyl-3-oxo-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propanoic acid
CID 82821865
2-amino-3,3,3-trifluoro-2-methyl-1-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-one
CID 79793264
(2-aminophenyl)-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methanone
CID 60959685
4-amino-3-methoxy-1-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-1-one
CID 103155298
ethyl 2-[[4-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]amino]acetate
CID 20907546
2-amino-1-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone;N,N-dimethylformamide;methane
CID 142427585
(5-bromothiophen-2-yl)-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methanone
CID 60776103

Frequently Asked Questions

What is the IUPAC name of 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide?
The IUPAC name of 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide (CID 61059386) is 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide is NC(=O)N1CCC(CN2CCCC2)CC1.
What is the InChIKey of 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide?
The InChIKey is WRVULMHTEUNIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c12-11(15)14-7-3-10(4-8-14)9-13-5-1-2-6-13/h10H,1-9H2,(H2,12,15).
What are the key properties of 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide?
4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide has a molecular weight of 211.31 g/mol, XLogP of 0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyrrolidin-1-ylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 61059386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).