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

C14H28ClN — CID 115683928

IUPAC1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride
SMILESCC(NCC1(C)CCC1)C1CCCCC1.Cl
InChIInChI=1S/C14H27N.ClH/c1-12(13-7-4-3-5-8-13)15-11-14(2)9-6-10-14;/h12-13,15H,3-11H2,1-2H3;1H
InChIKeyNSXLLCOLKUOVDH-UHFFFAOYSA-N
MW245.84 g/mol
LogP4.16
Rot. Bonds4

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

1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride (PubChem CID 115683928) has the molecular formula C14H28ClN and a molecular weight of 245.84 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride
PubChem CID115683928
Molecular FormulaC14H28ClN
Molecular Weight245.84 g/mol
Exact Mass245.19
IUPAC Name1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride
SMILESCC(NCC1(C)CCC1)C1CCCCC1.Cl
InChIInChI=1S/C14H27N.ClH/c1-12(13-7-4-3-5-8-13)15-11-14(2)9-6-10-14;/h12-13,15H,3-11H2,1-2H3;1H
InChIKeyNSXLLCOLKUOVDH-UHFFFAOYSA-N
XLogP4.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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

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CID 7558
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CID 221524
(alphaS)-N,alpha-Dimethylcyclohexaneethanamine
CID 71197
4-tert-butyl-N-methylcyclohexan-1-amine
CID 15921596
4-tert-butyl-N-propan-2-ylcyclohexan-1-amine
CID 9120262
Propylhexedrine hydrochloride, (S)-
CID 111166
Cyclohexanemethylamine, N-cyclopropyl-alpha-methyl-
CID 202159
Propylhexedrine hydrochloride, (R)-
CID 111164
[(1S)-1-cyclohexylethyl](methyl)amine
CID 15194969
7-Methyl-6-azaspiro(3.4)octane hydrochloride
CID 86775606
5-Methyl-6-azaspiro(3.5)nonane
CID 118001603

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride?
The IUPAC name of 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride (CID 115683928) is 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride?
The canonical SMILES for 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride is CC(NCC1(C)CCC1)C1CCCCC1.Cl.
What is the InChIKey of 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride?
The InChIKey is NSXLLCOLKUOVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N.ClH/c1-12(13-7-4-3-5-8-13)15-11-14(2)9-6-10-14;/h12-13,15H,3-11H2,1-2H3;1H.
What are the key properties of 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride?
1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride has a molecular weight of 245.84 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(1-methylcyclobutyl)methyl]ethanamine;hydrochloride is sourced from PubChem (CID 115683928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).