1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride

C15H31ClN2 — CID 120857850

IUPAC1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride
SMILESCC(C1CCCCC1)N(C)CC1CCCNC1.Cl
InChIInChI=1S/C15H30N2.ClH/c1-13(15-8-4-3-5-9-15)17(2)12-14-7-6-10-16-11-14;/h13-16H,3-12H2,1-2H3;1H
InChIKeyUHEBCEUQNYPBOK-UHFFFAOYSA-N
MW274.88 g/mol
LogP3.31
Rot. Bonds4

About 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride

1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride (PubChem CID 120857850) has the molecular formula C15H31ClN2 and a molecular weight of 274.88 g/mol. Its IUPAC name is 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride
PubChem CID120857850
Molecular FormulaC15H31ClN2
Molecular Weight274.88 g/mol
Exact Mass274.22
IUPAC Name1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride
SMILESCC(C1CCCCC1)N(C)CC1CCCNC1.Cl
InChIInChI=1S/C15H30N2.ClH/c1-13(15-8-4-3-5-9-15)17(2)12-14-7-6-10-16-11-14;/h13-16H,3-12H2,1-2H3;1H
InChIKeyUHEBCEUQNYPBOK-UHFFFAOYSA-N
XLogP3.31
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.88
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-cyclohexyl-N-methyl-N-(piperidin-4-ylmethyl)ethanamine
CID 120848749
1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)methanamine;hydrochloride
CID 119930005
N-cyclopentyl-2-[methyl(piperidin-3-ylmethyl)amino]propanamide
CID 106636337
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
1-methoxy-N-methyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 61452791
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine;hydrochloride
CID 119930509
1-cyclohexyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylmethanesulfonamide
CID 106630965
2-[1-[methyl(piperidin-3-ylmethyl)amino]ethyl]phenol
CID 104870411
2-[methyl(piperidin-3-ylmethyl)amino]-N-propylpropanamide
CID 106636555
N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106623701
1-(3,4-dichlorophenyl)-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride
CID 120847721
N-methyl-1-(2-methylphenyl)-N-(piperidin-3-ylmethyl)propan-2-amine;hydrochloride
CID 120858044

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride?
The IUPAC name of 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride (CID 120857850) is 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride?
The canonical SMILES for 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride is CC(C1CCCCC1)N(C)CC1CCCNC1.Cl.
What is the InChIKey of 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride?
The InChIKey is UHEBCEUQNYPBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2.ClH/c1-13(15-8-4-3-5-9-15)17(2)12-14-7-6-10-16-11-14;/h13-16H,3-12H2,1-2H3;1H.
What are the key properties of 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride?
1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride has a molecular weight of 274.88 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)ethanamine;hydrochloride is sourced from PubChem (CID 120857850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).