[1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine

C15H30N2 — CID 114959766

IUPAC[1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine
SMILESCC1CCC(C)C(N2CCC(C)C(CN)C2)C1
InChIInChI=1S/C15H30N2/c1-11-4-5-13(3)15(8-11)17-7-6-12(2)14(9-16)10-17/h11-15H,4-10,16H2,1-3H3
InChIKeyFIMUGOHTOPNDQR-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.73
Rot. Bonds2

About [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine

[1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine (PubChem CID 114959766) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine
PubChem CID114959766
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name[1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine
SMILESCC1CCC(C)C(N2CCC(C)C(CN)C2)C1
InChIInChI=1S/C15H30N2/c1-11-4-5-13(3)15(8-11)17-7-6-12(2)14(9-16)10-17/h11-15H,4-10,16H2,1-3H3
InChIKeyFIMUGOHTOPNDQR-UHFFFAOYSA-N
XLogP2.73
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methylpiperidin-3-yl]methanamine
CID 114959788
[2-(3-methoxy-4-methylpiperidin-1-yl)-4-methylcyclohexyl]methanamine
CID 102956549
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]cyclopentan-1-ol
CID 114961215
[1-(2,6-dimethyloxan-4-yl)-4-methylpiperidin-3-yl]methanamine
CID 114960162
[1-(3-methoxycyclobutyl)-4-methylpiperidin-3-yl]methanamine
CID 106823035
[1-(1,2-dimethylpiperidin-4-yl)-4-methylpiperidin-3-yl]methanamine
CID 114960031
[1-(4-tert-butylcyclohexyl)-4-methylpiperidin-3-yl]methanamine
CID 114960180
1-[1-[2-(aminomethyl)-5-methylcyclohexyl]pyrrolidin-3-yl]ethanol
CID 112624686
1-(2,4-dimethylcyclohexyl)-3-ethylpiperidin-4-amine
CID 81458379
1-(2,4-dimethylcyclohexyl)-3-methylpiperidin-4-amine
CID 63996480
1-(2,5-dimethylcyclohexyl)-5-methylpiperidin-3-amine
CID 79986356
[1-(2,5-dimethylcyclohexyl)piperidin-2-yl]methanamine
CID 64756399

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine?
The IUPAC name of [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine (CID 114959766) is [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine.
What is the SMILES notation for [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine?
The canonical SMILES for [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine is CC1CCC(C)C(N2CCC(C)C(CN)C2)C1.
What is the InChIKey of [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine?
The InChIKey is FIMUGOHTOPNDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-11-4-5-13(3)15(8-11)17-7-6-12(2)14(9-16)10-17/h11-15H,4-10,16H2,1-3H3.
What are the key properties of [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine?
[1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine has a molecular weight of 238.42 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylcyclohexyl)-4-methylpiperidin-3-yl]methanamine is sourced from PubChem (CID 114959766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).