N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine

C17H15N3 — CID 82535700

IUPACN-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine
SMILESc1ccc(Nc2ccc(Cc3ccncc3)cc2)nc1
InChIInChI=1S/C17H15N3/c1-2-10-19-17(3-1)20-16-6-4-14(5-7-16)13-15-8-11-18-12-9-15/h1-12H,13H2,(H,19,20)
InChIKeyNDMOELMQNDLIHR-UHFFFAOYSA-N
MW261.33 g/mol
LogP3.81
Rot. Bonds4

About N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine

N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine (PubChem CID 82535700) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine
PubChem CID82535700
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC NameN-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine
SMILESc1ccc(Nc2ccc(Cc3ccncc3)cc2)nc1
InChIInChI=1S/C17H15N3/c1-2-10-19-17(3-1)20-16-6-4-14(5-7-16)13-15-8-11-18-12-9-15/h1-12H,13H2,(H,19,20)
InChIKeyNDMOELMQNDLIHR-UHFFFAOYSA-N
XLogP3.81
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-dipyridin-2-ylbenzene-1,4-diamine
CID 139175237
4-N-[4-(pyridin-4-ylmethyl)phenyl]pyrimidine-2,4-diamine
CID 174921115
N-(4-chlorophenyl)pyridin-2-amine
CID 139075249
4-[[4-(pyridin-4-ylmethyl)phenyl]methyl]pyridine
CID 20646252
2-N,2-N-dimethyl-1-N-[4-(pyridin-4-ylmethyl)phenyl]benzene-1,2-diamine
CID 110452966
N-pyridin-2-ylpyridin-2-amine;hydrochloride
CID 517616
4-[4-(pyridin-4-ylmethyl)anilino]benzoic acid
CID 110452968
N-diphenylphosphoryl-4-(pyridin-4-ylmethyl)aniline
CID 17139379
6-N-phenyl-4-N-pyridin-2-ylpyrimidine-4,6-diamine
CID 117085780
N-[4-[(4-anilinophenyl)methyl]phenyl]-4-benzylaniline
CID 159021817
N-(4-pyrazin-2-yloxyphenyl)pyridin-2-amine
CID 59374194
N-hydroxy-2-oxo-8-[4-(pyridin-2-ylamino)phenyl]octanamide
CID 123826019

Frequently Asked Questions

What is the IUPAC name of N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine?
The IUPAC name of N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine (CID 82535700) is N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine.
What is the SMILES notation for N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine?
The canonical SMILES for N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine is c1ccc(Nc2ccc(Cc3ccncc3)cc2)nc1.
What is the InChIKey of N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine?
The InChIKey is NDMOELMQNDLIHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-2-10-19-17(3-1)20-16-6-4-14(5-7-16)13-15-8-11-18-12-9-15/h1-12H,13H2,(H,19,20).
What are the key properties of N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine?
N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine has a molecular weight of 261.33 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(pyridin-4-ylmethyl)phenyl]pyridin-2-amine is sourced from PubChem (CID 82535700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).