N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine

C16H24N2 — CID 83991728

IUPACN-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine
SMILESCc1cccc(N2CC(C)CC(NC3CC3)C2)c1
InChIInChI=1S/C16H24N2/c1-12-4-3-5-16(9-12)18-10-13(2)8-15(11-18)17-14-6-7-14/h3-5,9,13-15,17H,6-8,10-11H2,1-2H3
InChIKeyKTYDIWJGGFWKLW-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.96
Rot. Bonds3

About N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine

N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine (PubChem CID 83991728) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine
PubChem CID83991728
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine
SMILESCc1cccc(N2CC(C)CC(NC3CC3)C2)c1
InChIInChI=1S/C16H24N2/c1-12-4-3-5-16(9-12)18-10-13(2)8-15(11-18)17-14-6-7-14/h3-5,9,13-15,17H,6-8,10-11H2,1-2H3
InChIKeyKTYDIWJGGFWKLW-UHFFFAOYSA-N
XLogP2.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methylphenyl)-3,6-diazabicyclo[3.1.1]heptane
CID 84770848
N-cyclopropyl-1-(2,4-difluorophenyl)-5-methylpiperidin-3-amine
CID 83991736
N-(cyclopropylmethyl)-1-(3-methoxyphenyl)-5-methylpiperidin-3-amine
CID 83996532
N-cyclohexyl-5-methyl-1-thiophen-3-ylpiperidin-3-amine
CID 83999300
N-ethyl-1-(3-methoxyphenyl)-5-methylpiperidin-3-amine
CID 83990440
N-(cyclopentylmethyl)-1-(3-fluorophenyl)-5-methylpiperidin-3-amine
CID 83997928
1-(3,5-dimethylpiperidin-1-yl)-2-[4-(3-methylphenyl)piperazin-1-yl]ethane-1,2-dione
CID 108520633
N-(cyclohexylmethyl)-1-(3-methoxyphenyl)-5-methylpiperidin-3-amine
CID 83998607
(4R,8R)-4,8-dimethyl-6-(3-methylphenyl)-1,3,6-dioxazocan-2-one
CID 13329277
3-methyl-N-[(1R,3R)-3-methylcyclopentyl]aniline
CID 95376117
1-(3,4-difluorophenyl)-N,5-dimethylpiperidin-3-amine
CID 83989825
N-(2,2-difluoroethyl)-1-(3-methoxyphenyl)-5-methylpiperidin-3-amine
CID 83993074

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine?
The IUPAC name of N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine (CID 83991728) is N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine.
What is the SMILES notation for N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine?
The canonical SMILES for N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine is Cc1cccc(N2CC(C)CC(NC3CC3)C2)c1.
What is the InChIKey of N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine?
The InChIKey is KTYDIWJGGFWKLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-12-4-3-5-16(9-12)18-10-13(2)8-15(11-18)17-14-6-7-14/h3-5,9,13-15,17H,6-8,10-11H2,1-2H3.
What are the key properties of N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine?
N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine has a molecular weight of 244.38 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-methyl-1-(3-methylphenyl)piperidin-3-amine is sourced from PubChem (CID 83991728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).