2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine

C16H32N2 — CID 64736445

IUPAC2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
SMILESCC1CC(C)C(CN2CCC(C)CC2C)C(N)C1
InChIInChI=1S/C16H32N2/c1-11-5-6-18(14(4)8-11)10-15-13(3)7-12(2)9-16(15)17/h11-16H,5-10,17H2,1-4H3
InChIKeySLCJEOJSCMZMPR-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.12
Rot. Bonds2

About 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine

2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine (PubChem CID 64736445) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
PubChem CID64736445
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
SMILESCC1CC(C)C(CN2CCC(C)CC2C)C(N)C1
InChIInChI=1S/C16H32N2/c1-11-5-6-18(14(4)8-11)10-15-13(3)7-12(2)9-16(15)17/h11-16H,5-10,17H2,1-4H3
InChIKeySLCJEOJSCMZMPR-UHFFFAOYSA-N
XLogP3.12
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine
CID 130718623
2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine
CID 62610380
1-[(2-amino-4,6-dimethylcyclohexyl)methyl]piperidin-4-ol
CID 64736403
3,5-dimethyl-2-[(3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 64736017
2-[(3,5-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64736208
[1-[(2-amino-4,6-dimethylcyclohexyl)methyl]piperidin-4-yl]methanol
CID 64735025
1-[(2-amino-4,6-dimethylcyclohexyl)methyl]-N,N-dimethylpyrrolidin-3-amine
CID 64734685
2-[(4-cyclopentylpiperazin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64736642
3,5-dimethyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine
CID 64735839
3,5-dimethyl-2-[(3-propan-2-ylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 113418838
3,5-dimethyl-2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclohexan-1-amine
CID 64735862
3,5-dimethyl-2-[(3-methylsulfonylthiomorpholin-4-yl)methyl]cyclohexan-1-amine
CID 66381850

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine (CID 64736445) is 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine is CC1CC(C)C(CN2CCC(C)CC2C)C(N)C1.
What is the InChIKey of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
The InChIKey is SLCJEOJSCMZMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-11-5-6-18(14(4)8-11)10-15-13(3)7-12(2)9-16(15)17/h11-16H,5-10,17H2,1-4H3.
What are the key properties of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine?
2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethylpiperidin-1-yl)methyl]-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 64736445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).