(4S)-2-ethyl-4-methylcyclopentan-1-amine

C8H17N — CID 163423682

IUPAC(4S)-2-ethyl-4-methylcyclopentan-1-amine
SMILESCCC1C[C@H](C)CC1N
InChIInChI=1S/C8H17N/c1-3-7-4-6(2)5-8(7)9/h6-8H,3-5,9H2,1-2H3/t6-,7?,8?/m0/s1
InChIKeyAKQLLKXTMIZBAT-KKMMWDRVSA-N
MW127.23 g/mol
LogP1.77
Rot. Bonds1

About (4S)-2-ethyl-4-methylcyclopentan-1-amine

(4S)-2-ethyl-4-methylcyclopentan-1-amine (PubChem CID 163423682) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is (4S)-2-ethyl-4-methylcyclopentan-1-amine.

Molecular Properties

Compound Name(4S)-2-ethyl-4-methylcyclopentan-1-amine
PubChem CID163423682
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name(4S)-2-ethyl-4-methylcyclopentan-1-amine
SMILESCCC1C[C@H](C)CC1N
InChIInChI=1S/C8H17N/c1-3-7-4-6(2)5-8(7)9/h6-8H,3-5,9H2,1-2H3/t6-,7?,8?/m0/s1
InChIKeyAKQLLKXTMIZBAT-KKMMWDRVSA-N
XLogP1.77
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-iodoethyl)-4-methylcyclopentan-1-amine
CID 155097003
1-ethyl-2-fluoro-4-methylcyclopentane
CID 91088664
1-chloro-2-ethyl-4-methylcyclopentane
CID 174663037
(1S,2R,6R)-2-ethyl-4-methylbicyclo[4.1.0]heptane
CID 144517019
(1R,2S,4R)-2,4-dimethylcyclopentan-1-amine
CID 134253027
3-ethyl-5-methylcyclohexane-1,2-diol
CID 118343814
1-chloro-3-ethyl-2,5-dimethylcyclohexane
CID 170272561
4-(4-amino-3-ethylcyclohexyl)-2-ethylcyclohexan-1-amine
CID 67929401
(1S,2S,4S)-2-ethyl-1,4-dimethylcyclohexane
CID 145320876
5-ethyl-2,3,4-trimethylcyclohexan-1-amine
CID 144529983
cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane
CID 143682309
1,3-diethyl-2,5-dimethylcycloheptane
CID 123338571

Frequently Asked Questions

What is the IUPAC name of (4S)-2-ethyl-4-methylcyclopentan-1-amine?
The IUPAC name of (4S)-2-ethyl-4-methylcyclopentan-1-amine (CID 163423682) is (4S)-2-ethyl-4-methylcyclopentan-1-amine.
What is the SMILES notation for (4S)-2-ethyl-4-methylcyclopentan-1-amine?
The canonical SMILES for (4S)-2-ethyl-4-methylcyclopentan-1-amine is CCC1C[C@H](C)CC1N.
What is the InChIKey of (4S)-2-ethyl-4-methylcyclopentan-1-amine?
The InChIKey is AKQLLKXTMIZBAT-KKMMWDRVSA-N. The full InChI is InChI=1S/C8H17N/c1-3-7-4-6(2)5-8(7)9/h6-8H,3-5,9H2,1-2H3/t6-,7?,8?/m0/s1.
What are the key properties of (4S)-2-ethyl-4-methylcyclopentan-1-amine?
(4S)-2-ethyl-4-methylcyclopentan-1-amine has a molecular weight of 127.23 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-2-ethyl-4-methylcyclopentan-1-amine is sourced from PubChem (CID 163423682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).