N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide

C9H16N2O — CID 66004927

IUPACN-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide
SMILESNC1CC(CNC(=O)C2CC2)C1
InChIInChI=1S/C9H16N2O/c10-8-3-6(4-8)5-11-9(12)7-1-2-7/h6-8H,1-5,10H2,(H,11,12)
InChIKeyCPSNVUBAXUYSMK-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.25
Rot. Bonds3

About N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide

N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide (PubChem CID 66004927) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide
PubChem CID66004927
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC NameN-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide
SMILESNC1CC(CNC(=O)C2CC2)C1
InChIInChI=1S/C9H16N2O/c10-8-3-6(4-8)5-11-9(12)7-1-2-7/h6-8H,1-5,10H2,(H,11,12)
InChIKeyCPSNVUBAXUYSMK-UHFFFAOYSA-N
XLogP0.25
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-aminocyclobutyl)methyl]-4-butylcyclohexane-1-carboxamide
CID 66004520
N-(cyclobutylmethyl)cyclopropanecarboxamide
CID 60757387
N-[(3-aminocyclopentyl)methyl]-4-tert-butylcyclohexane-1-carboxamide
CID 106121672
N-[(3-hydroxycyclopentyl)methyl]cyclopropanecarboxamide
CID 103280320
4-[(cyclopropanecarbonylamino)methyl]cyclohexane-1-carboxylic acid
CID 79525311
N-[(3-bromocyclobutyl)methyl]cyclobutanecarboxamide
CID 165454239
N-[(3-aminocyclohexyl)methyl]oxane-4-carboxamide
CID 106123693
N-[[4-[(cyclopentanecarbonylamino)methyl]cyclohexyl]methyl]cyclopentanecarboxamide
CID 125471839
N-[(3-aminocyclopentyl)methyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxamide
CID 106121226
N-[(3-aminocyclohexyl)methyl]bicyclo[3.1.0]hexane-3-carboxamide
CID 114146502
3-amino-N-[(3-hydroxycyclobutyl)methyl]cyclohexane-1-carboxamide
CID 66005543
N-[(3-hydroxycyclobutyl)methyl]piperidine-4-carboxamide
CID 66006145

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide (CID 66004927) is N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide is NC1CC(CNC(=O)C2CC2)C1.
What is the InChIKey of N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide?
The InChIKey is CPSNVUBAXUYSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c10-8-3-6(4-8)5-11-9(12)7-1-2-7/h6-8H,1-5,10H2,(H,11,12).
What are the key properties of N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide?
N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide has a molecular weight of 168.24 g/mol, XLogP of 0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclobutyl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 66004927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).