[3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine

C10H20N2O — CID 116945013

IUPAC[3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine
SMILESNCC1(C(N)C2CCCC2)COC1
InChIInChI=1S/C10H20N2O/c11-5-10(6-13-7-10)9(12)8-3-1-2-4-8/h8-9H,1-7,11-12H2
InChIKeyQZSAMFVTNXEONA-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.48
Rot. Bonds3

About [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine

[3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine (PubChem CID 116945013) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine.

Molecular Properties

Compound Name[3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine
PubChem CID116945013
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name[3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine
SMILESNCC1(C(N)C2CCCC2)COC1
InChIInChI=1S/C10H20N2O/c11-5-10(6-13-7-10)9(12)8-3-1-2-4-8/h8-9H,1-7,11-12H2
InChIKeyQZSAMFVTNXEONA-UHFFFAOYSA-N
XLogP0.48
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(difluoromethyl)oxetan-3-yl]methanamine
CID 105427900
cyclohexyl-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943616
(R)-[4-(aminomethyl)oxan-4-yl]-cyclobutylmethanol
CID 97035401
(3-butan-2-yloxetan-3-yl)methanamine
CID 139418018
[4-[amino(cyclopropyl)methyl]oxan-4-yl]methanol
CID 119056884
cyclopentyl-(4-ethoxyoxan-4-yl)methanamine
CID 116765524
[3-(cyclopentylmethyl)oxetan-3-yl]methanamine
CID 116930584
(1S)-1-cyclopentylethane-1,2-diamine
CID 55292792
[1-(aminomethyl)cyclobutyl]-(1-methylpyrrolidin-3-yl)methanamine
CID 116943914
[3-(aminomethyl)oxolan-3-yl]-(oxolan-3-yl)methanol
CID 79138729
[3-(cyclohexylmethyl)oxetan-3-yl]methanamine
CID 116930585
[1-(aminomethyl)-4,4-dimethylcyclohexyl]-cycloheptylmethanol
CID 79126283

Frequently Asked Questions

What is the IUPAC name of [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine?
The IUPAC name of [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine (CID 116945013) is [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine.
What is the SMILES notation for [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine?
The canonical SMILES for [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine is NCC1(C(N)C2CCCC2)COC1.
What is the InChIKey of [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine?
The InChIKey is QZSAMFVTNXEONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c11-5-10(6-13-7-10)9(12)8-3-1-2-4-8/h8-9H,1-7,11-12H2.
What are the key properties of [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine?
[3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine has a molecular weight of 184.28 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(aminomethyl)oxetan-3-yl]-cyclopentylmethanamine is sourced from PubChem (CID 116945013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).