N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide

C9H17N3O — CID 79161437

IUPACN-(3-aminocyclobutyl)pyrrolidine-1-carboxamide
SMILESNC1CC(NC(=O)N2CCCC2)C1
InChIInChI=1S/C9H17N3O/c10-7-5-8(6-7)11-9(13)12-3-1-2-4-12/h7-8H,1-6,10H2,(H,11,13)
InChIKeyHTZYVGIZZZYWCN-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.28
Rot. Bonds1

About N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide

N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide (PubChem CID 79161437) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)pyrrolidine-1-carboxamide
PubChem CID79161437
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-(3-aminocyclobutyl)pyrrolidine-1-carboxamide
SMILESNC1CC(NC(=O)N2CCCC2)C1
InChIInChI=1S/C9H17N3O/c10-7-5-8(6-7)11-9(13)12-3-1-2-4-12/h7-8H,1-6,10H2,(H,11,13)
InChIKeyHTZYVGIZZZYWCN-UHFFFAOYSA-N
XLogP0.28
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-aminocyclohexyl)azepane-1-carboxamide
CID 79152451
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
3-[(4-aminopiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 55147693
cis-(1R,3S)-3-(azocane-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 106324241
N-[4-(methylamino)cyclohexyl]piperidine-1-carboxamide
CID 79156160
N-(1-methylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 18723341
N-[4-(methylamino)cyclohexyl]azepane-1-carboxamide
CID 79152452
N-(1-iodopiperidin-4-yl)pyrrolidine-1-carboxamide
CID 142009370
N-(1,5-dimethylpyrrolidin-3-yl)pyrrolidine-1-carboxamide
CID 53424206
N-(4-oxocyclohexyl)pyrrolidine-1-carboxamide
CID 79161033
N-pyrrolidin-3-ylazepane-1-carboxamide
CID 79151743
N-(3,3,5,5-tetramethylcyclohexyl)pyrrolidine-1-carboxamide
CID 113353990

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide (CID 79161437) is N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide is NC1CC(NC(=O)N2CCCC2)C1.
What is the InChIKey of N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide?
The InChIKey is HTZYVGIZZZYWCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c10-7-5-8(6-7)11-9(13)12-3-1-2-4-12/h7-8H,1-6,10H2,(H,11,13).
What are the key properties of N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide?
N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 79161437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).