4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide

C15H29N3O — CID 83024704

IUPAC4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide
SMILESCC1CC(C(=O)NN2C(C)CCCC2C)CCC1N
InChIInChI=1S/C15H29N3O/c1-10-9-13(7-8-14(10)16)15(19)17-18-11(2)5-4-6-12(18)3/h10-14H,4-9,16H2,1-3H3,(H,17,19)
InChIKeyBIIRUDVQVAUNMD-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.04
Rot. Bonds2

About 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide

4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide (PubChem CID 83024704) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide
PubChem CID83024704
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide
SMILESCC1CC(C(=O)NN2C(C)CCCC2C)CCC1N
InChIInChI=1S/C15H29N3O/c1-10-9-13(7-8-14(10)16)15(19)17-18-11(2)5-4-6-12(18)3/h10-14H,4-9,16H2,1-3H3,(H,17,19)
InChIKeyBIIRUDVQVAUNMD-UHFFFAOYSA-N
XLogP2.04
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 62777735
4-amino-N-(2,6-dimethylpiperidin-1-yl)-2,2,3-trimethylcyclohexane-1-carboxamide
CID 102629161
4-amino-N-(3,5-dimethylcyclohexyl)-3-methylcyclohexane-1-carboxamide
CID 64733535
4-amino-3-methyl-N-(3-pyrrolidin-1-ylpropyl)cyclohexane-1-carboxamide
CID 55139778
4-amino-N-(1-cyclohexylethyl)-3-methylcyclohexane-1-carboxamide
CID 55116861
4-amino-N-butyl-3-methylcyclohexane-1-carboxamide
CID 62782491
4-amino-3-methyl-N-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 62782835
4-amino-3-methyl-N-(oxan-4-yl)cyclohexane-1-carboxamide
CID 62783524
4-amino-N-(2-cyclopentyloxyethyl)-3-methylcyclohexane-1-carboxamide
CID 63832217
4-amino-N-[2-(dimethylamino)propyl]-3-methylcyclohexane-1-carboxamide
CID 62782736
4-amino-3-methyl-N-(3,3,3-trifluoropropyl)cyclohexane-1-carboxamide
CID 63231231
4-amino-N-(3-ethylpentan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 63840862

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide (CID 83024704) is 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide is CC1CC(C(=O)NN2C(C)CCCC2C)CCC1N.
What is the InChIKey of 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide?
The InChIKey is BIIRUDVQVAUNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-10-9-13(7-8-14(10)16)15(19)17-18-11(2)5-4-6-12(18)3/h10-14H,4-9,16H2,1-3H3,(H,17,19).
What are the key properties of 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide?
4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide has a molecular weight of 267.42 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 83024704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).