N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine

C15H23ClN2 — CID 43665303

IUPACN-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCc1ccc(Cl)cc1NC1CC(C)N(C)CC1C
InChIInChI=1S/C15H23ClN2/c1-10-5-6-13(16)8-15(10)17-14-7-12(3)18(4)9-11(14)2/h5-6,8,11-12,14,17H,7,9H2,1-4H3
InChIKeyKUMYJOPVNAKYHX-UHFFFAOYSA-N
MW266.82 g/mol
LogP3.79
Rot. Bonds2

About N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine

N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 43665303) has the molecular formula C15H23ClN2 and a molecular weight of 266.82 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID43665303
Molecular FormulaC15H23ClN2
Molecular Weight266.82 g/mol
Exact Mass266.15
IUPAC NameN-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCc1ccc(Cl)cc1NC1CC(C)N(C)CC1C
InChIInChI=1S/C15H23ClN2/c1-10-5-6-13(16)8-15(10)17-14-7-12(3)18(4)9-11(14)2/h5-6,8,11-12,14,17H,7,9H2,1-4H3
InChIKeyKUMYJOPVNAKYHX-UHFFFAOYSA-N
XLogP3.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.82
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,5-trimethyl-N-(2-methyl-5-nitrophenyl)piperidin-4-amine
CID 43718577
N-(4-chlorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665402
2,5-dimethyl-4-[(1,2,5-trimethylpiperidin-4-yl)amino]phenol
CID 106953917
N-(3-methoxy-2,4-dimethylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43739091
6-chloro-5-methyl-N-(1,2,5-trimethylpiperidin-4-yl)pyridin-3-amine
CID 114049259
N-(4-bromo-2,6-dimethylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 54863711
N-(4,5-dimethyl-2-nitrophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 62098099
N-(4-chloro-3-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 107270537
N-(3-chloro-4-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665336
1,2,5-trimethyl-N-[2-(trifluoromethyl)phenyl]piperidin-4-amine
CID 43665342
N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-1,2,5-trimethylpiperidin-4-amine
CID 43723369
2-chloro-N-methyl-5-[(1,2,5-trimethylpiperidin-4-yl)amino]benzamide
CID 60936196

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine (CID 43665303) is N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine is Cc1ccc(Cl)cc1NC1CC(C)N(C)CC1C.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is KUMYJOPVNAKYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2/c1-10-5-6-13(16)8-15(10)17-14-7-12(3)18(4)9-11(14)2/h5-6,8,11-12,14,17H,7,9H2,1-4H3.
What are the key properties of N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine?
N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 266.82 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 43665303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).