[(1S,2R)-2-ethylcyclohexyl]methanamine

C9H19N — CID 124508805

IUPAC[(1S,2R)-2-ethylcyclohexyl]methanamine
SMILESCC[C@@H]1CCCC[C@@H]1CN
InChIInChI=1S/C9H19N/c1-2-8-5-3-4-6-9(8)7-10/h8-9H,2-7,10H2,1H3/t8-,9-/m1/s1
InChIKeySYYXPQCKXWLCCA-RKDXNWHRSA-N
MW141.26 g/mol
LogP2.16
Rot. Bonds2

About [(1S,2R)-2-ethylcyclohexyl]methanamine

[(1S,2R)-2-ethylcyclohexyl]methanamine (PubChem CID 124508805) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is [(1S,2R)-2-ethylcyclohexyl]methanamine.

Molecular Properties

Compound Name[(1S,2R)-2-ethylcyclohexyl]methanamine
PubChem CID124508805
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name[(1S,2R)-2-ethylcyclohexyl]methanamine
SMILESCC[C@@H]1CCCC[C@@H]1CN
InChIInChI=1S/C9H19N/c1-2-8-5-3-4-6-9(8)7-10/h8-9H,2-7,10H2,1H3/t8-,9-/m1/s1
InChIKeySYYXPQCKXWLCCA-RKDXNWHRSA-N
XLogP2.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-ethylcyclobutyl)methanamine
CID 58519219
CID 160611346
CID 160611346
(1R)-1-ethyl-2-propylcyclohexane
CID 142312859
ethane;(2S)-1-ethyl-2-propylcyclohexane
CID 143012565
[(1S,2S)-2-propylcyclopentyl]methanamine
CID 124512847
[2-(aminomethyl)cyclobutyl]methanamine;hydrochloride
CID 175788563
trans-(1R,2R)-2-(aminomethyl)cyclohexan-1-amine;dihydrochloride
CID 163198683
(2-methylcyclodecyl)methanamine
CID 163635360
carbonic acid;1,2-diethylcyclohexane
CID 70579518
[(1R,2R)-2-ethylcyclohexyl]methanol
CID 58154483
[(1S,2S)-2-butan-2-ylcyclohexyl]methanamine
CID 167231134
[(1R,2S)-2-propan-2-ylcyclohexyl]methanamine
CID 166498577

Frequently Asked Questions

What is the IUPAC name of [(1S,2R)-2-ethylcyclohexyl]methanamine?
The IUPAC name of [(1S,2R)-2-ethylcyclohexyl]methanamine (CID 124508805) is [(1S,2R)-2-ethylcyclohexyl]methanamine.
What is the SMILES notation for [(1S,2R)-2-ethylcyclohexyl]methanamine?
The canonical SMILES for [(1S,2R)-2-ethylcyclohexyl]methanamine is CC[C@@H]1CCCC[C@@H]1CN.
What is the InChIKey of [(1S,2R)-2-ethylcyclohexyl]methanamine?
The InChIKey is SYYXPQCKXWLCCA-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H19N/c1-2-8-5-3-4-6-9(8)7-10/h8-9H,2-7,10H2,1H3/t8-,9-/m1/s1.
What are the key properties of [(1S,2R)-2-ethylcyclohexyl]methanamine?
[(1S,2R)-2-ethylcyclohexyl]methanamine has a molecular weight of 141.26 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2R)-2-ethylcyclohexyl]methanamine is sourced from PubChem (CID 124508805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).