N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide

C12H23N3O — CID 115590525

IUPACN-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide
SMILESCC(CN1CCCC1)NC(=O)N1CCCC1
InChIInChI=1S/C12H23N3O/c1-11(10-14-6-2-3-7-14)13-12(16)15-8-4-5-9-15/h11H,2-10H2,1H3,(H,13,16)
InChIKeyIJJSKGDJOBOTBF-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.28
Rot. Bonds3

About N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide

N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide (PubChem CID 115590525) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide
PubChem CID115590525
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide
SMILESCC(CN1CCCC1)NC(=O)N1CCCC1
InChIInChI=1S/C12H23N3O/c1-11(10-14-6-2-3-7-14)13-12(16)15-8-4-5-9-15/h11H,2-10H2,1H3,(H,13,16)
InChIKeyIJJSKGDJOBOTBF-UHFFFAOYSA-N
XLogP1.28
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-piperidin-1-ylpropan-2-yl)azepane-1-carboxamide
CID 115583840
N-(1-piperidin-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115579823
4-methyl-N-(1-piperidin-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583839
N-[1-(azepan-1-yl)propan-2-yl]-4-hydroxy-4-methylazepane-1-carboxamide
CID 122144357
N-butan-2-ylpyrrolidine-1-carboxamide
CID 17217776
3-hydroxy-N-(1-piperidin-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 78892643
N-(1-pyrrolidin-1-ylpropan-2-yl)acetamide
CID 61217024
3-methyl-1-(1-pyrrolidin-1-ylpropan-2-ylcarbamoyl)piperidine-3-carboxylic acid
CID 63136898
N-(1-hydroxypropan-2-yl)azepane-1-carboxamide
CID 112729482
3-methyl-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]piperidine-1-carboxamide
CID 60577941
4-(2-phenylethyl)-N-[(2S)-1-pyrrolidin-1-ylpropan-2-yl]piperazine-1-carboxamide
CID 125445404
4,4-dimethyl-N-[(2S)-1-(4-methylpiperazin-1-yl)propan-2-yl]azepane-1-carboxamide
CID 95934326

Frequently Asked Questions

What is the IUPAC name of N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide (CID 115590525) is N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide is CC(CN1CCCC1)NC(=O)N1CCCC1.
What is the InChIKey of N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide?
The InChIKey is IJJSKGDJOBOTBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-11(10-14-6-2-3-7-14)13-12(16)15-8-4-5-9-15/h11H,2-10H2,1H3,(H,13,16).
What are the key properties of N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide?
N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide has a molecular weight of 225.34 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrrolidin-1-ylpropan-2-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 115590525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).