N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine

C13H27N — CID 82930868

IUPACN-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine
SMILESCCC(CC)CC(C)C(C)NC1CC1
InChIInChI=1S/C13H27N/c1-5-12(6-2)9-10(3)11(4)14-13-7-8-13/h10-14H,5-9H2,1-4H3
InChIKeyYEWHDXWYRBVAPE-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.59
Rot. Bonds7

About N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine

N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine (PubChem CID 82930868) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine.

Molecular Properties

Compound NameN-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine
PubChem CID82930868
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC NameN-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine
SMILESCCC(CC)CC(C)C(C)NC1CC1
InChIInChI=1S/C13H27N/c1-5-12(6-2)9-10(3)11(4)14-13-7-8-13/h10-14H,5-9H2,1-4H3
InChIKeyYEWHDXWYRBVAPE-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine 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

4-(3-methylpentan-2-ylamino)cyclohexan-1-ol
CID 43201193
N-(3-methylpentan-2-yl)-4-propylcyclohexan-1-amine
CID 63456173
N-(3-methylbutan-2-yl)cyclopropanamine
CID 16772546
4-ethyl-N-(3-ethylpentan-2-yl)cyclohexan-1-amine
CID 63842608
N-(4-methylhexan-2-yl)cyclopropanamine
CID 103439280
N-(3-ethylpentan-2-yl)cyclohexanamine
CID 63842425
1-methyl-N-(3-methylpentan-2-yl)azepan-4-amine
CID 65070746
3-[(4-methoxycyclohexyl)amino]-2-methylbutan-1-ol
CID 104530280
N-butan-2-yl-4-propan-2-ylcyclohexan-1-amine
CID 62702797
2-(cyclopropylamino)-3-methylpentanoic acid
CID 61319137
2-methoxy-1-[4-(3-methylpentan-2-ylamino)piperidin-1-yl]ethanone
CID 43747506
5-ethyl-2,3-dimethyl-N-propan-2-ylheptan-1-amine
CID 82934817

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine?
The IUPAC name of N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine (CID 82930868) is N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine.
What is the SMILES notation for N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine?
The canonical SMILES for N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine is CCC(CC)CC(C)C(C)NC1CC1.
What is the InChIKey of N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine?
The InChIKey is YEWHDXWYRBVAPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-5-12(6-2)9-10(3)11(4)14-13-7-8-13/h10-14H,5-9H2,1-4H3.
What are the key properties of N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine?
N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine has a molecular weight of 197.37 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-3-methylheptan-2-yl)cyclopropanamine is sourced from PubChem (CID 82930868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).