1-(3-methylcyclobutyl)-N-propylbutan-1-amine

C12H25N — CID 103565371

IUPAC1-(3-methylcyclobutyl)-N-propylbutan-1-amine
SMILESCCCNC(CCC)C1CC(C)C1
InChIInChI=1S/C12H25N/c1-4-6-12(13-7-5-2)11-8-10(3)9-11/h10-13H,4-9H2,1-3H3
InChIKeyPVWRTSFEIAWKCS-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds6

About 1-(3-methylcyclobutyl)-N-propylbutan-1-amine

1-(3-methylcyclobutyl)-N-propylbutan-1-amine (PubChem CID 103565371) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-(3-methylcyclobutyl)-N-propylbutan-1-amine.

Molecular Properties

Compound Name1-(3-methylcyclobutyl)-N-propylbutan-1-amine
PubChem CID103565371
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-(3-methylcyclobutyl)-N-propylbutan-1-amine
SMILESCCCNC(CCC)C1CC(C)C1
InChIInChI=1S/C12H25N/c1-4-6-12(13-7-5-2)11-8-10(3)9-11/h10-13H,4-9H2,1-3H3
InChIKeyPVWRTSFEIAWKCS-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(3-methylcyclobutyl)-N-propylbutan-1-amine 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

1-(4-methylcyclohexyl)-N-propylpentan-1-amine
CID 63415743
N-[1-(3,5-dimethylcyclohexyl)-2-(1-methoxycyclobutyl)ethyl]propan-1-amine
CID 103559419
1-(3-methylcyclopentyl)-4-methylsulfonyl-N-propylbutan-1-amine
CID 65415614
N-[(3,5-dimethylcyclohexyl)-(4-methylcyclohexyl)methyl]propan-1-amine
CID 64729509
1-(3,5-dimethylcyclohexyl)-2,3-dimethyl-N-propylbutan-1-amine
CID 104988659
1-(3-ethoxycyclobutyl)-N-propylpropan-1-amine
CID 106824581
1-cyclopropyl-N-propylhexan-1-amine
CID 62600983
3-methyl-1-(3-methylcyclopentyl)-N-propylbut-3-en-1-amine
CID 79185600
N-[1-(4-methylcyclohexyl)-2-propan-2-yloxyethyl]propan-1-amine
CID 79575417
N-[2-cyclopropyl-1-(4-methylcyclohexyl)ethyl]propan-1-amine
CID 64907023
1-cyclopropyl-N-propyltridecan-1-amine
CID 63413531
N-butyl-1-cyclopentylbutan-1-amine
CID 173232536

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylcyclobutyl)-N-propylbutan-1-amine?
The IUPAC name of 1-(3-methylcyclobutyl)-N-propylbutan-1-amine (CID 103565371) is 1-(3-methylcyclobutyl)-N-propylbutan-1-amine.
What is the SMILES notation for 1-(3-methylcyclobutyl)-N-propylbutan-1-amine?
The canonical SMILES for 1-(3-methylcyclobutyl)-N-propylbutan-1-amine is CCCNC(CCC)C1CC(C)C1.
What is the InChIKey of 1-(3-methylcyclobutyl)-N-propylbutan-1-amine?
The InChIKey is PVWRTSFEIAWKCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-4-6-12(13-7-5-2)11-8-10(3)9-11/h10-13H,4-9H2,1-3H3.
What are the key properties of 1-(3-methylcyclobutyl)-N-propylbutan-1-amine?
1-(3-methylcyclobutyl)-N-propylbutan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylcyclobutyl)-N-propylbutan-1-amine is sourced from PubChem (CID 103565371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).