N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine

C13H27NO — CID 103037532

IUPACN-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine
SMILESCCNC1CCC(CCC(C)(C)OC)C1
InChIInChI=1S/C13H27NO/c1-5-14-12-7-6-11(10-12)8-9-13(2,3)15-4/h11-12,14H,5-10H2,1-4H3
InChIKeyIQFCLFSBVPKRSW-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.97
Rot. Bonds6

About N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine

N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine (PubChem CID 103037532) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine
PubChem CID103037532
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine
SMILESCCNC1CCC(CCC(C)(C)OC)C1
InChIInChI=1S/C13H27NO/c1-5-14-12-7-6-11(10-12)8-9-13(2,3)15-4/h11-12,14H,5-10H2,1-4H3
InChIKeyIQFCLFSBVPKRSW-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-3-(3-methoxy-3-methylbutyl)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

3-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
CID 103037519
4-ethyl-N-(2-methoxy-2-methylpropyl)cyclohexan-1-amine
CID 115656258
2-(3-methoxy-3-methylbutyl)-N-methyl-4-propylcyclohexan-1-amine
CID 103034583
1-bromo-3-(3-methoxy-3-methylbutyl)cycloheptane
CID 103037607
N-ethyl-4-(3-methoxy-3-methylbutyl)thiolan-3-amine
CID 103034615
N-ethyl-3-(2-methylpropyl)cyclopentan-1-amine
CID 64504045
5-(3-methoxy-3-methylbutyl)-2-methylpiperidine
CID 106777707
4-chloro-N-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
CID 103037173
(3S)-3-N-ethyl-1-N-methylcyclopentane-1,3-diamine
CID 171100893
N-(3-methoxy-3-methylbutyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 106675122
4-ethyl-2-(3-methoxy-3-methylbutyl)piperidine
CID 103037375
N-ethylcyclopropanamine;hydrochloride
CID 43810659

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine?
The IUPAC name of N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine (CID 103037532) is N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine?
The canonical SMILES for N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine is CCNC1CCC(CCC(C)(C)OC)C1.
What is the InChIKey of N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine?
The InChIKey is IQFCLFSBVPKRSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-5-14-12-7-6-11(10-12)8-9-13(2,3)15-4/h11-12,14H,5-10H2,1-4H3.
What are the key properties of N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine?
N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methoxy-3-methylbutyl)cyclopentan-1-amine is sourced from PubChem (CID 103037532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).