N-[[3-(aminomethyl)cyclobutyl]methyl]formamide

C7H14N2O — CID 166140310

IUPACN-[[3-(aminomethyl)cyclobutyl]methyl]formamide
SMILESNCC1CC(CNC=O)C1
InChIInChI=1S/C7H14N2O/c8-3-6-1-7(2-6)4-9-5-10/h5-7H,1-4,8H2,(H,9,10)
InChIKeyAFURHAQJRYNPOE-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.28
Rot. Bonds4

About N-[[3-(aminomethyl)cyclobutyl]methyl]formamide

N-[[3-(aminomethyl)cyclobutyl]methyl]formamide (PubChem CID 166140310) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-[[3-(aminomethyl)cyclobutyl]methyl]formamide.

Molecular Properties

Compound NameN-[[3-(aminomethyl)cyclobutyl]methyl]formamide
PubChem CID166140310
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-[[3-(aminomethyl)cyclobutyl]methyl]formamide
SMILESNCC1CC(CNC=O)C1
InChIInChI=1S/C7H14N2O/c8-3-6-1-7(2-6)4-9-5-10/h5-7H,1-4,8H2,(H,9,10)
InChIKeyAFURHAQJRYNPOE-UHFFFAOYSA-N
XLogP-0.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[[3-(aminomethyl)cyclohexyl]methyl]formamide
CID 87717758
N-[(3-methyl-5-propylcyclohexyl)methyl]formamide
CID 135142700
N-[(3,3-difluorocyclobutyl)methyl]formamide
CID 130859227
N-[(4-ethylcyclohexyl)methyl]formamide
CID 64992922
[(1S,3S)-3-(aminomethyl)cyclohexyl]methanamine
CID 6951512
N-[(1-methylsulfonylpiperidin-4-yl)methyl]formamide
CID 174528757
ethane;N-[(1-methylpyrrolidin-3-yl)methyl]formamide
CID 145231026
N-(2-cyclobutylethyl)formamide
CID 87467337
N-[[3-[(ethenylamino)methyl]cyclohexyl]methyl]ethenamine
CID 139712766
1-[(1R,3R)-3-(aminomethyl)cyclohexyl]propan-2-one
CID 98010324
ethane;methanamine;[3-(methylaminomethyl)cyclohexyl]methanamine
CID 142040832
[3-[[[4-[[[3-(aminomethyl)cyclohexyl]methylamino]methyl]phenyl]methylamino]methyl]cyclohexyl]methanamine
CID 145151914

Frequently Asked Questions

What is the IUPAC name of N-[[3-(aminomethyl)cyclobutyl]methyl]formamide?
The IUPAC name of N-[[3-(aminomethyl)cyclobutyl]methyl]formamide (CID 166140310) is N-[[3-(aminomethyl)cyclobutyl]methyl]formamide.
What is the SMILES notation for N-[[3-(aminomethyl)cyclobutyl]methyl]formamide?
The canonical SMILES for N-[[3-(aminomethyl)cyclobutyl]methyl]formamide is NCC1CC(CNC=O)C1.
What is the InChIKey of N-[[3-(aminomethyl)cyclobutyl]methyl]formamide?
The InChIKey is AFURHAQJRYNPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c8-3-6-1-7(2-6)4-9-5-10/h5-7H,1-4,8H2,(H,9,10).
What are the key properties of N-[[3-(aminomethyl)cyclobutyl]methyl]formamide?
N-[[3-(aminomethyl)cyclobutyl]methyl]formamide has a molecular weight of 142.20 g/mol, XLogP of -0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(aminomethyl)cyclobutyl]methyl]formamide is sourced from PubChem (CID 166140310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).