N-[2-(3-methylphenyl)ethyl]pyridin-4-amine

C14H16N2 — CID 62315390

IUPACN-[2-(3-methylphenyl)ethyl]pyridin-4-amine
SMILESCc1cccc(CCNc2ccncc2)c1
InChIInChI=1S/C14H16N2/c1-12-3-2-4-13(11-12)5-10-16-14-6-8-15-9-7-14/h2-4,6-9,11H,5,10H2,1H3,(H,15,16)
InChIKeyWVQXANZBGRHJJU-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.04
Rot. Bonds4

About N-[2-(3-methylphenyl)ethyl]pyridin-4-amine

N-[2-(3-methylphenyl)ethyl]pyridin-4-amine (PubChem CID 62315390) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is N-[2-(3-methylphenyl)ethyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[2-(3-methylphenyl)ethyl]pyridin-4-amine
PubChem CID62315390
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC NameN-[2-(3-methylphenyl)ethyl]pyridin-4-amine
SMILESCc1cccc(CCNc2ccncc2)c1
InChIInChI=1S/C14H16N2/c1-12-3-2-4-13(11-12)5-10-16-14-6-8-15-9-7-14/h2-4,6-9,11H,5,10H2,1H3,(H,15,16)
InChIKeyWVQXANZBGRHJJU-UHFFFAOYSA-N
XLogP3.04
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-N-[2-(3-methylphenyl)ethyl]aniline
CID 22960583
N-[2-(3-methylphenyl)ethyl]-4-(trifluoromethyl)aniline
CID 63539979
5-N-[2-(3-methylphenyl)ethyl]pyridine-2,5-diamine
CID 62314086
3-chloro-N-[2-(3-methylphenyl)ethyl]aniline
CID 68835949
4-fluoro-N-[2-(3-methylphenyl)ethyl]aniline;trichlorophosphane
CID 90944409
1-[4-[2-(3-methylphenyl)ethylamino]phenyl]ethanone
CID 114468210
3-[2-(pyridin-4-ylamino)ethyl]benzoic acid
CID 55236658
N-[3-(3-methylphenyl)propyl]aniline
CID 62365007
4-N-[2-(3-methylphenyl)ethyl]benzene-1,2,4-triamine
CID 106750720
4-[2-(3-methylphenyl)ethylamino]benzenecarbothioamide
CID 62314669
1-[3-(3-methylphenyl)propyl]-3-pyridin-4-ylthiourea
CID 100614381
4,6-dimethyl-N-[2-(3-methylphenyl)ethyl]pyrimidin-2-amine
CID 62313023

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylphenyl)ethyl]pyridin-4-amine?
The IUPAC name of N-[2-(3-methylphenyl)ethyl]pyridin-4-amine (CID 62315390) is N-[2-(3-methylphenyl)ethyl]pyridin-4-amine.
What is the SMILES notation for N-[2-(3-methylphenyl)ethyl]pyridin-4-amine?
The canonical SMILES for N-[2-(3-methylphenyl)ethyl]pyridin-4-amine is Cc1cccc(CCNc2ccncc2)c1.
What is the InChIKey of N-[2-(3-methylphenyl)ethyl]pyridin-4-amine?
The InChIKey is WVQXANZBGRHJJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-12-3-2-4-13(11-12)5-10-16-14-6-8-15-9-7-14/h2-4,6-9,11H,5,10H2,1H3,(H,15,16).
What are the key properties of N-[2-(3-methylphenyl)ethyl]pyridin-4-amine?
N-[2-(3-methylphenyl)ethyl]pyridin-4-amine has a molecular weight of 212.30 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methylphenyl)ethyl]pyridin-4-amine is sourced from PubChem (CID 62315390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).