N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide

C15H16N4O — CID 162464588

IUPACN-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide
SMILESNc1ccc(-c2ccccc2)nc1NC(=O)N1CCC1
InChIInChI=1S/C15H16N4O/c16-12-7-8-13(11-5-2-1-3-6-11)17-14(12)18-15(20)19-9-4-10-19/h1-3,5-8H,4,9-10,16H2,(H,17,18,20)
InChIKeyDQXJMSKUEZLTCF-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.57
Rot. Bonds2

About N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide

N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide (PubChem CID 162464588) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide
PubChem CID162464588
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide
SMILESNc1ccc(-c2ccccc2)nc1NC(=O)N1CCC1
InChIInChI=1S/C15H16N4O/c16-12-7-8-13(11-5-2-1-3-6-11)17-14(12)18-15(20)19-9-4-10-19/h1-3,5-8H,4,9-10,16H2,(H,17,18,20)
InChIKeyDQXJMSKUEZLTCF-UHFFFAOYSA-N
XLogP2.57
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide?
The IUPAC name of N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide (CID 162464588) is N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide.
What is the SMILES notation for N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide?
The canonical SMILES for N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide is Nc1ccc(-c2ccccc2)nc1NC(=O)N1CCC1.
What is the InChIKey of N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide?
The InChIKey is DQXJMSKUEZLTCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c16-12-7-8-13(11-5-2-1-3-6-11)17-14(12)18-15(20)19-9-4-10-19/h1-3,5-8H,4,9-10,16H2,(H,17,18,20).
What are the key properties of N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide?
N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-6-phenyl-2-pyridinyl)azetidine-1-carboxamide is sourced from PubChem (CID 162464588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).