N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine

C13H25N — CID 130736733

IUPACN-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(NC(C)C2CC2(C)C)C1
InChIInChI=1S/C13H25N/c1-9-5-6-11(7-9)14-10(2)12-8-13(12,3)4/h9-12,14H,5-8H2,1-4H3
InChIKeyGGQMQIRZFHCVTF-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds3

About N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine

N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine (PubChem CID 130736733) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine
PubChem CID130736733
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine
SMILESCC1CCC(NC(C)C2CC2(C)C)C1
InChIInChI=1S/C13H25N/c1-9-5-6-11(7-9)14-10(2)12-8-13(12,3)4/h9-12,14H,5-8H2,1-4H3
InChIKeyGGQMQIRZFHCVTF-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

trans-(1S,3S)-3-methyl-N-propan-2-ylcyclopentan-1-amine
CID 58394445
(1R)-3-methyl-N-propan-2-ylcyclopentan-1-amine
CID 58394376
N-[(1S)-1-cyclohexylethyl]-3-methylcyclopentan-1-amine
CID 81387418
N-[1-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]-3-methylcyclopentan-1-amine
CID 114543889
(2S)-2-[[(1S,3R)-3-methylcyclopentyl]amino]propan-1-ol
CID 95368773
(2S)-2-[(3-methylcyclopentyl)amino]propan-1-ol
CID 103773858
N-[1-(2,2-dimethylcyclopropyl)ethyl]propan-1-amine
CID 107004121
N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine
CID 43775460
cis-(1S,3R)-N-[(2S)-1-methoxypropan-2-yl]-3-methylcyclopentan-1-amine
CID 95368713
1-(2,2-dimethylcyclopropyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 107004571
3-methyl-N-(2,2,3,3-tetramethylcyclopropyl)cyclopentan-1-amine
CID 79358790
N-(3-methylcyclopentyl)-4-propan-2-ylcyclohexan-1-amine
CID 114543996

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine?
The IUPAC name of N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine (CID 130736733) is N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine.
What is the SMILES notation for N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine?
The canonical SMILES for N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine is CC1CCC(NC(C)C2CC2(C)C)C1.
What is the InChIKey of N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine?
The InChIKey is GGQMQIRZFHCVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-9-5-6-11(7-9)14-10(2)12-8-13(12,3)4/h9-12,14H,5-8H2,1-4H3.
What are the key properties of N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine?
N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,2-dimethylcyclopropyl)ethyl]-3-methylcyclopentan-1-amine is sourced from PubChem (CID 130736733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).