N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine

C13H25N — CID 66039281

IUPACN-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine
SMILESC=C(CC)CC1CCC(NCC)C1C
InChIInChI=1S/C13H25N/c1-5-10(3)9-12-7-8-13(11(12)4)14-6-2/h11-14H,3,5-9H2,1-2,4H3
InChIKeyBOJSEZSOHBVHFI-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.37
Rot. Bonds5

About N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine

N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine (PubChem CID 66039281) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine
PubChem CID66039281
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine
SMILESC=C(CC)CC1CCC(NCC)C1C
InChIInChI=1S/C13H25N/c1-5-10(3)9-12-7-8-13(11(12)4)14-6-2/h11-14H,3,5-9H2,1-2,4H3
InChIKeyBOJSEZSOHBVHFI-UHFFFAOYSA-N
XLogP3.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-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

N-(2-methylpropyl)-2-prop-2-enylcyclopentan-1-amine
CID 85614648
(4R,5S,7R)-4-[(2S)-but-3-en-2-yl]-7-prop-2-enyl-6-azaspiro[4.5]decane
CID 139262780
2-(3-methylbut-1-en-2-yl)-N-propan-2-ylcyclopentan-1-amine
CID 58718140
3-(3-methylbut-1-en-2-yl)-N-propan-2-ylcyclopentan-1-amine
CID 58718142
N-(3,3,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13-henicosamethyltetradecan-2-yl)-1,2,2,3,3-pentamethyl-5-methylidenecyclopentan-1-amine
CID 59870401
(1R)-N-(3,3,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13-henicosamethyltetradecan-2-yl)-1,2,2,3,3-pentamethyl-5-methylidenecyclopentan-1-amine
CID 59870402
N-[[4-(aminomethyl)cyclohex-3-en-1-yl]methyl]-2-butyl-3-methylcyclopentan-1-amine
CID 70947951
5-ethyl-2,9,10-trimethyl-8-methylidene-N-propan-2-ylundecan-4-amine
CID 90878934
N,3-diethyl-4-ethylidene-2,3-dimethylcyclopentan-1-amine
CID 91010030
2-methyl-5-methylidene-N-propan-2-ylcyclopentan-1-amine
CID 91297581
N-(11-ethyl-3,5,11-trimethyltridecyl)-3,3-dimethyl-2,4-dimethylidenecyclopentan-1-amine
CID 91398532
(2R)-N',2-dimethyl-N'-[(1R)-3-(3-methylbut-3-enyl)cyclopentyl]propane-1,3-diamine
CID 117861850

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine?
The IUPAC name of N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine (CID 66039281) is N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine is C=C(CC)CC1CCC(NCC)C1C.
What is the InChIKey of N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine?
The InChIKey is BOJSEZSOHBVHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-5-10(3)9-12-7-8-13(11(12)4)14-6-2/h11-14H,3,5-9H2,1-2,4H3.
What are the key properties of N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine?
N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-3-(2-methylidenebutyl)cyclopentan-1-amine is sourced from PubChem (CID 66039281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).