1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride

C14H28ClN — CID 115683925

IUPAC1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride
SMILESCCC1(CNC(C)C2CCCCC2)CC1.Cl
InChIInChI=1S/C14H27N.ClH/c1-3-14(9-10-14)11-15-12(2)13-7-5-4-6-8-13;/h12-13,15H,3-11H2,1-2H3;1H
InChIKeyMXEMALXBCGOWCK-UHFFFAOYSA-N
MW245.84 g/mol
LogP4.16
Rot. Bonds5

About 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride

1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride (PubChem CID 115683925) has the molecular formula C14H28ClN and a molecular weight of 245.84 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride
PubChem CID115683925
Molecular FormulaC14H28ClN
Molecular Weight245.84 g/mol
Exact Mass245.19
IUPAC Name1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride
SMILESCCC1(CNC(C)C2CCCCC2)CC1.Cl
InChIInChI=1S/C14H27N.ClH/c1-3-14(9-10-14)11-15-12(2)13-7-5-4-6-8-13;/h12-13,15H,3-11H2,1-2H3;1H
InChIKeyMXEMALXBCGOWCK-UHFFFAOYSA-N
XLogP4.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.84
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride
CID 115683928
[1-[(1-cyclopentylethylamino)methyl]cyclohexyl]methanol
CID 81419658
N-[(1-ethylcyclopropyl)methyl]propan-2-amine
CID 66026004
2-[1-[(1-cyclopentylethylamino)methyl]cyclobutyl]ethanol
CID 115894754
1-cyclopropyl-N-[(1-propylcyclopropyl)methyl]ethanamine
CID 103903725
1-[[[(1R)-1-cyclohexylethyl]amino]methyl]cyclohexan-1-ol
CID 81385046
1-cyclopentyl-N-ethylethanamine
CID 60819244
N-[(1R)-1-cycloheptylethyl]propan-1-amine
CID 81393503
(1S)-1-cycloheptyl-N-[(3-methyloxetan-3-yl)methyl]ethanamine
CID 81393158
1-cyclohexyl-N-[(2-methylthiolan-2-yl)methyl]ethanamine
CID 80725460
1-[(1-cyclobutylethylamino)methyl]cyclopentan-1-ol
CID 115719650
1-cyclopentyl-N-[(4-methyloxan-4-yl)methyl]ethanamine
CID 115893016

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride?
The IUPAC name of 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride (CID 115683925) is 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride?
The canonical SMILES for 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride is CCC1(CNC(C)C2CCCCC2)CC1.Cl.
What is the InChIKey of 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride?
The InChIKey is MXEMALXBCGOWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N.ClH/c1-3-14(9-10-14)11-15-12(2)13-7-5-4-6-8-13;/h12-13,15H,3-11H2,1-2H3;1H.
What are the key properties of 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride?
1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride has a molecular weight of 245.84 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(1-ethylcyclopropyl)methyl]ethanamine;hydrochloride is sourced from PubChem (CID 115683925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).