N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine

C15H14N4 — CID 20561064

IUPACN-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine
SMILESc1ccc(CNc2cc(-c3cnc[nH]3)ccn2)cc1
InChIInChI=1S/C15H14N4/c1-2-4-12(5-3-1)9-18-15-8-13(6-7-17-15)14-10-16-11-19-14/h1-8,10-11H,9H2,(H,16,19)(H,17,18)
InChIKeyVFYUPELWTDVBHF-UHFFFAOYSA-N
MW250.31 g/mol
LogP3.08
Rot. Bonds4

About N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine

N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine (PubChem CID 20561064) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine
PubChem CID20561064
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC NameN-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine
SMILESc1ccc(CNc2cc(-c3cnc[nH]3)ccn2)cc1
InChIInChI=1S/C15H14N4/c1-2-4-12(5-3-1)9-18-15-8-13(6-7-17-15)14-10-16-11-19-14/h1-8,10-11H,9H2,(H,16,19)(H,17,18)
InChIKeyVFYUPELWTDVBHF-UHFFFAOYSA-N
XLogP3.08
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-benzyl-4-(4-methyl-1,2,4-triazol-3-yl)pyridin-2-amine
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N-benzyl-4-methoxypyridin-2-amine
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2-[3-(1H-imidazol-5-yl)phenyl]acetic acid
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N-benzyl-4-imidazolidin-1-ylpyridin-2-amine
CID 143912574
N-(1H-imidazol-5-ylmethyl)pyridin-2-amine
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4-(1H-imidazol-5-yl)-2-phenylpyrimidine
CID 90707377
2-(pyridin-3-ylmethylamino)pyridine-4-carboxylic acid
CID 29037275
2-(benzylamino)pyridine-4-carbothioamide
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine?
The IUPAC name of N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine (CID 20561064) is N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine.
What is the SMILES notation for N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine?
The canonical SMILES for N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine is c1ccc(CNc2cc(-c3cnc[nH]3)ccn2)cc1.
What is the InChIKey of N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine?
The InChIKey is VFYUPELWTDVBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-2-4-12(5-3-1)9-18-15-8-13(6-7-17-15)14-10-16-11-19-14/h1-8,10-11H,9H2,(H,16,19)(H,17,18).
What are the key properties of N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine?
N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine has a molecular weight of 250.31 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(1H-imidazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 20561064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).