2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide

C14H14N4O — CID 144793221

IUPAC2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide
SMILES[H]/N=C(\C(N)=O)c1ccccc1Nc1cc(C)ccn1
InChIInChI=1S/C14H14N4O/c1-9-6-7-17-12(8-9)18-11-5-3-2-4-10(11)13(15)14(16)19/h2-8,15H,1H3,(H2,16,19)(H,17,18)/b15-13-
InChIKeyLPSKJHXRVBADEP-SQFISAMPSA-N
MW254.29 g/mol
LogP1.99
Rot. Bonds4

About 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide

2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide (PubChem CID 144793221) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide
PubChem CID144793221
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide
SMILES[H]/N=C(\C(N)=O)c1ccccc1Nc1cc(C)ccn1
InChIInChI=1S/C14H14N4O/c1-9-6-7-17-12(8-9)18-11-5-3-2-4-10(11)13(15)14(16)19/h2-8,15H,1H3,(H2,16,19)(H,17,18)/b15-13-
InChIKeyLPSKJHXRVBADEP-SQFISAMPSA-N
XLogP1.99
TPSA91.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(2-carbamoylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 108529456
ethyl 2-[[5-amino-6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]amino]benzoate
CID 22545282
2-(4-methoxyanilino)-N-(4-methyl-2-pyridinyl)benzamide
CID 52612517
N-(2-methylphenyl)-N'-(4-methyl-2-pyridinyl)oxamide
CID 45000004
N-[2,3-bis(aminomethyl)phenyl]-4-methylpyridin-2-amine
CID 151683614
2-N-(5-amino-2-methoxy-4-methylphenyl)-4-N-(2-ethanimidoylphenyl)pyridine-2,4-diamine
CID 163999010
2-[[6-(3-methylanilino)pyrimidin-4-yl]amino]benzoic acid
CID 113195056
2-[[2-(4-methylphenyl)-4-pyridinyl]amino]benzamide
CID 117077072
2,4-dichloro-N-[2-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]benzamide
CID 1339954
N-[2-[[6-[(4-methyl-2-pyridinyl)amino]pyridazin-3-yl]amino]ethyl]benzamide
CID 121064497
N-(2-fluoro-4-methylphenyl)-4-methylpyridin-2-amine
CID 91756465
N'-[5-amino-6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]-2-fluorobenzohydrazide
CID 22545221

Frequently Asked Questions

What is the IUPAC name of 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide?
The IUPAC name of 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide (CID 144793221) is 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide.
What is the SMILES notation for 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide?
The canonical SMILES for 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide is [H]/N=C(\C(N)=O)c1ccccc1Nc1cc(C)ccn1.
What is the InChIKey of 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide?
The InChIKey is LPSKJHXRVBADEP-SQFISAMPSA-N. The full InChI is InChI=1S/C14H14N4O/c1-9-6-7-17-12(8-9)18-11-5-3-2-4-10(11)13(15)14(16)19/h2-8,15H,1H3,(H2,16,19)(H,17,18)/b15-13-.
What are the key properties of 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide?
2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide has a molecular weight of 254.29 g/mol, XLogP of 1.99, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imino-2-[2-[(4-methyl-2-pyridinyl)amino]phenyl]acetamide is sourced from PubChem (CID 144793221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).