N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine

C18H28N2 — CID 83999699

IUPACN-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine
SMILESCc1ccc(C2CC(NC3CCCC3)CN(C)C2)cc1
InChIInChI=1S/C18H28N2/c1-14-7-9-15(10-8-14)16-11-18(13-20(2)12-16)19-17-5-3-4-6-17/h7-10,16-19H,3-6,11-13H2,1-2H3
InChIKeySCOUBCUWETUBTF-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.31
Rot. Bonds3

About N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine

N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine (PubChem CID 83999699) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine
PubChem CID83999699
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC NameN-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine
SMILESCc1ccc(C2CC(NC3CCCC3)CN(C)C2)cc1
InChIInChI=1S/C18H28N2/c1-14-7-9-15(10-8-14)16-11-18(13-20(2)12-16)19-17-5-3-4-6-17/h7-10,16-19H,3-6,11-13H2,1-2H3
InChIKeySCOUBCUWETUBTF-UHFFFAOYSA-N
XLogP3.31
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-1-methyl-5-phenylpiperidin-3-amine
CID 83999692
1-methyl-N-[3-(4-methylphenyl)cyclobutyl]piperidin-3-amine
CID 61210851
N-cyclopropyl-5-(4-ethylphenyl)-1-methylpiperidin-3-amine
CID 83991454
N-[1-methyl-5-(4-methylphenyl)piperidin-3-yl]acetamide
CID 112541665
1-methyl-5-(4-methylphenyl)-N-(2,2,2-trifluoroethyl)piperidin-3-amine
CID 83992089
2,2-dimethyl-N-[1-methyl-5-(4-methylphenyl)piperidin-3-yl]propanamide
CID 112542110
N-[3-(4-bromophenyl)cyclobutyl]-1-methylpiperidin-3-amine
CID 61211031
N-cyclohexyl-1-ethyl-5-phenylpiperidin-3-amine
CID 83999040
N-cyclohexyl-1-ethyl-5-(3-methylphenyl)piperidin-3-amine
CID 83999044
N-[3-(4-fluorophenyl)cyclobutyl]cyclopentanamine
CID 43632694
N,1-dimethyl-5-(3-methylphenyl)piperidin-3-amine
CID 83989556
N-[3-(3-methylphenyl)cyclobutyl]cyclopentanamine
CID 43632705

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine?
The IUPAC name of N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine (CID 83999699) is N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine.
What is the SMILES notation for N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine?
The canonical SMILES for N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine is Cc1ccc(C2CC(NC3CCCC3)CN(C)C2)cc1.
What is the InChIKey of N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine?
The InChIKey is SCOUBCUWETUBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-14-7-9-15(10-8-14)16-11-18(13-20(2)12-16)19-17-5-3-4-6-17/h7-10,16-19H,3-6,11-13H2,1-2H3.
What are the key properties of N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine?
N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine has a molecular weight of 272.44 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-methyl-5-(4-methylphenyl)piperidin-3-amine is sourced from PubChem (CID 83999699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).