3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine

C14H29N3 — CID 60701471

IUPAC3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NCCN2CCN(C)CC2)C1
InChIInChI=1S/C14H29N3/c1-13-4-3-5-14(12-13)15-6-7-17-10-8-16(2)9-11-17/h13-15H,3-12H2,1-2H3
InChIKeySVERQJYBGQHSBA-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.40
Rot. Bonds4

About 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine

3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine (PubChem CID 60701471) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine
PubChem CID60701471
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NCCN2CCN(C)CC2)C1
InChIInChI=1S/C14H29N3/c1-13-4-3-5-14(12-13)15-6-7-17-10-8-16(2)9-11-17/h13-15H,3-12H2,1-2H3
InChIKeySVERQJYBGQHSBA-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 55024069
3-methyl-N-[2-(4-propylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 62573742
N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 62561082
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclopentanamine
CID 60701361
N-[2-(3,4-dimethylpiperazin-1-yl)ethyl]-3-methylcyclohexan-1-amine
CID 63620169
3-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentan-1-amine
CID 64501657
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexanamine
CID 60701363
N-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-3-methylcyclohexan-1-amine
CID 63979129
3-methyl-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine
CID 43181773
1-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azepan-4-amine
CID 65070783
N,N-dimethyl-1-[2-[(3-methylcyclohexyl)amino]ethyl]pyrrolidin-3-amine
CID 63167443
3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclohexan-1-amine
CID 66372208

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine (CID 60701471) is 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine is CC1CCCC(NCCN2CCN(C)CC2)C1.
What is the InChIKey of 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine?
The InChIKey is SVERQJYBGQHSBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-13-4-3-5-14(12-13)15-6-7-17-10-8-16(2)9-11-17/h13-15H,3-12H2,1-2H3.
What are the key properties of 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine?
3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 60701471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).