ethane;3-ethylcyclohexan-1-amine

C10H23N — CID 164855900

IUPACethane;3-ethylcyclohexan-1-amine
SMILESCC.CCC1CCCC(N)C1
InChIInChI=1S/C8H17N.C2H6/c1-2-7-4-3-5-8(9)6-7;1-2/h7-8H,2-6,9H2,1H3;1-2H3
InChIKeyQBCKJIHHPYWZGJ-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.94
Rot. Bonds1

About ethane;3-ethylcyclohexan-1-amine

ethane;3-ethylcyclohexan-1-amine (PubChem CID 164855900) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is ethane;3-ethylcyclohexan-1-amine.

Molecular Properties

Compound Nameethane;3-ethylcyclohexan-1-amine
PubChem CID164855900
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Nameethane;3-ethylcyclohexan-1-amine
SMILESCC.CCC1CCCC(N)C1
InChIInChI=1S/C8H17N.C2H6/c1-2-7-4-3-5-8(9)6-7;1-2/h7-8H,2-6,9H2,1H3;1-2H3
InChIKeyQBCKJIHHPYWZGJ-UHFFFAOYSA-N
XLogP2.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethylcyclooctan-1-amine
CID 126707955
3-(3-ethylcyclohexyl)cyclohexan-1-amine
CID 64503181
(5S)-5-ethylcyclononan-1-amine
CID 163875041
3-(diethylaminomethyl)cyclohexan-1-amine
CID 63045933
3-(bromomethyl)cyclohexan-1-amine
CID 89245957
potassium;carbanide;3-ethylcyclohexan-1-amine;(3-methanidylcyclohexyl)methanamine
CID 177154465
ethylcyclobutane;methanamine
CID 175532329
3-N-(3-ethylcyclohexyl)cyclopentane-1,3-diamine
CID 79461810
ethane;ethene;ethylcyclobutane
CID 164586585
trans-(1S,3S)-1-ethyl-3-methylcyclohexane
CID 23620235
[(3S)-3-aminocyclohexyl]methanol
CID 131334541
ethane;bis(ethylcyclopentane)
CID 158911237

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethylcyclohexan-1-amine?
The IUPAC name of ethane;3-ethylcyclohexan-1-amine (CID 164855900) is ethane;3-ethylcyclohexan-1-amine.
What is the SMILES notation for ethane;3-ethylcyclohexan-1-amine?
The canonical SMILES for ethane;3-ethylcyclohexan-1-amine is CC.CCC1CCCC(N)C1.
What is the InChIKey of ethane;3-ethylcyclohexan-1-amine?
The InChIKey is QBCKJIHHPYWZGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.C2H6/c1-2-7-4-3-5-8(9)6-7;1-2/h7-8H,2-6,9H2,1H3;1-2H3.
What are the key properties of ethane;3-ethylcyclohexan-1-amine?
ethane;3-ethylcyclohexan-1-amine has a molecular weight of 157.30 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethylcyclohexan-1-amine is sourced from PubChem (CID 164855900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).