(1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol

C9H19NO — CID 97035537

IUPAC(1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol
SMILESCC[C@H](O)C1(CN)CC(C)C1
InChIInChI=1S/C9H19NO/c1-3-8(11)9(6-10)4-7(2)5-9/h7-8,11H,3-6,10H2,1-2H3/t7?,8-,9?/m0/s1
InChIKeySOZGMHJZNXLNMW-MGURRDGZSA-N
MW157.26 g/mol
LogP1.13
Rot. Bonds3

About (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol

(1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol (PubChem CID 97035537) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol.

Molecular Properties

Compound Name(1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol
PubChem CID97035537
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol
SMILESCC[C@H](O)C1(CN)CC(C)C1
InChIInChI=1S/C9H19NO/c1-3-8(11)9(6-10)4-7(2)5-9/h7-8,11H,3-6,10H2,1-2H3/t7?,8-,9?/m0/s1
InChIKeySOZGMHJZNXLNMW-MGURRDGZSA-N
XLogP1.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R)-1-[1-(aminomethyl)-3-methylcyclobutyl]pentan-1-ol
CID 97035451
1-[1-(aminomethyl)-3-methylcyclobutyl]-3-methylbutan-1-ol
CID 102547576
1-[1-(aminomethyl)-3-methylcyclopentyl]-3,3-dimethylbutan-1-ol
CID 79138322
(S)-[1-(aminomethyl)-3-methylcyclobutyl]-(4-fluorophenyl)methanol
CID 97035266
[1-(aminomethyl)-3-methylcyclopentyl]-(4-ethylphenyl)methanol
CID 79137757
(S)-[1-(aminomethyl)-3-methylcyclobutyl]-(2-methylphenyl)methanol
CID 97035285
(S)-[1-(aminomethyl)-3-methylcyclobutyl]-pyrazin-2-ylmethanol
CID 97035352
[1-(aminomethyl)-3-methylcyclobutyl]-(5-methylthiophen-2-yl)methanol
CID 102547503
1-(aminomethyl)-N,3-dimethyl-N-(2-methylbutyl)cyclobutan-1-amine
CID 103562600
1-[1-(aminomethyl)cyclopropyl]-2-methylbutan-1-ol
CID 130513360
1-[1-(aminomethyl)-4-methylcyclohexyl]-3-methoxy-3-methylbutan-1-ol
CID 106676604
1-(aminomethyl)-N-butan-2-yl-N,3-dimethylcyclobutane-1-carboxamide
CID 80588524

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol?
The IUPAC name of (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol (CID 97035537) is (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol.
What is the SMILES notation for (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol?
The canonical SMILES for (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol is CC[C@H](O)C1(CN)CC(C)C1.
What is the InChIKey of (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol?
The InChIKey is SOZGMHJZNXLNMW-MGURRDGZSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-8(11)9(6-10)4-7(2)5-9/h7-8,11H,3-6,10H2,1-2H3/t7?,8-,9?/m0/s1.
What are the key properties of (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol?
(1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[1-(aminomethyl)-3-methylcyclobutyl]propan-1-ol is sourced from PubChem (CID 97035537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).