3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine

C16H32N2 — CID 64746013

IUPAC3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCN(CCNC2CCC(C)C(C)C2)CC1
InChIInChI=1S/C16H32N2/c1-13-6-9-18(10-7-13)11-8-17-16-5-4-14(2)15(3)12-16/h13-17H,4-12H2,1-3H3
InChIKeySUXBHOVPQKYAOA-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.13
Rot. Bonds4

About 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine

3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine (PubChem CID 64746013) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine
PubChem CID64746013
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCN(CCNC2CCC(C)C(C)C2)CC1
InChIInChI=1S/C16H32N2/c1-13-6-9-18(10-7-13)11-8-17-16-5-4-14(2)15(3)12-16/h13-17H,4-12H2,1-3H3
InChIKeySUXBHOVPQKYAOA-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[[(1R,3S,4R)-3,4-dimethylcyclohexyl]amino]ethyl]-N,N-dimethylpiperidin-4-amine
CID 99627103
3,4-dimethyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine
CID 104854192
4-methyl-N-[2-(3-methylpyrrolidin-1-yl)ethyl]cyclohexan-1-amine
CID 62561809
3-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentan-1-amine
CID 64501657
tert-butyl N-[3-[2-(4-methylpiperidin-1-yl)ethylamino]cyclopentyl]carbamate
CID 103719839
4-methyl-N-(2-pyrrolidin-1-ylethyl)cyclohexan-1-amine;dihydrochloride
CID 154577414
3-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]cyclobutan-1-amine
CID 104859624
4-methyl-N-[2-(4-propylpiperidin-1-yl)ethyl]cyclohexan-1-amine
CID 63503899
3-methyl-N-(2-morpholin-4-ylethyl)cyclopentan-1-amine
CID 23767314
N-[2-[4-(cyclopropylmethyl)piperazin-1-yl]ethyl]-4-methylcyclohexan-1-amine
CID 62556569
N-[(1-ethylpiperidin-4-yl)methyl]-3,4-dimethylcyclohexan-1-amine
CID 64746015
3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 60701471

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine (CID 64746013) is 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine is CC1CCN(CCNC2CCC(C)C(C)C2)CC1.
What is the InChIKey of 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine?
The InChIKey is SUXBHOVPQKYAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-13-6-9-18(10-7-13)11-8-17-16-5-4-14(2)15(3)12-16/h13-17H,4-12H2,1-3H3.
What are the key properties of 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine?
3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 64746013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).