5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine

C14H15ClN2 — CID 54968175

IUPAC5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
SMILESCc1ccc(C(C)Nc2ccc(Cl)cn2)cc1
InChIInChI=1S/C14H15ClN2/c1-10-3-5-12(6-4-10)11(2)17-14-8-7-13(15)9-16-14/h3-9,11H,1-2H3,(H,16,17)
InChIKeyGNUYHACWFYIVGX-UHFFFAOYSA-N
MW246.74 g/mol
LogP4.22
Rot. Bonds3

About 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine

5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine (PubChem CID 54968175) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
PubChem CID54968175
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
SMILESCc1ccc(C(C)Nc2ccc(Cl)cn2)cc1
InChIInChI=1S/C14H15ClN2/c1-10-3-5-12(6-4-10)11(2)17-14-8-7-13(15)9-16-14/h3-9,11H,1-2H3,(H,16,17)
InChIKeyGNUYHACWFYIVGX-UHFFFAOYSA-N
XLogP4.22
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-aminophenyl)ethyl]-5-chloropyridin-2-amine
CID 60870794
5-chloro-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridin-2-amine
CID 97088603
5-chloro-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridin-2-amine
CID 97088604
2-N-[1-(4-methylphenyl)ethyl]pyrazine-2,5-diamine
CID 80652605
N-[1-(4-methoxyphenyl)ethyl]-5-methylpyridin-2-amine
CID 66244498
N-[(1R)-1-(4-chlorophenyl)ethyl]-5-nitropyridin-2-amine
CID 30640632
5-chloro-N-[1-(2,4-dichlorophenyl)ethyl]pyridin-2-amine
CID 43110954
N-[1-(4-methylphenyl)ethyl]pyrazin-2-amine
CID 60967003
6-methyl-N-[1-(4-methylphenyl)ethyl]pyridazin-3-amine
CID 54968124
(1S)-N-[1-(4-chlorophenyl)ethyl]-1-(4-methylphenyl)ethanamine
CID 81355634
5-(5-ethyl-3-pyridinyl)-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
CID 170311249
3-[1-[(5-chloro-2-pyridinyl)amino]ethyl]benzenesulfonamide
CID 71978290

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
The IUPAC name of 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine (CID 54968175) is 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine is Cc1ccc(C(C)Nc2ccc(Cl)cn2)cc1.
What is the InChIKey of 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
The InChIKey is GNUYHACWFYIVGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c1-10-3-5-12(6-4-10)11(2)17-14-8-7-13(15)9-16-14/h3-9,11H,1-2H3,(H,16,17).
What are the key properties of 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine has a molecular weight of 246.74 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 54968175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).