N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide

C17H17N3O3 — CID 91643425

IUPACN-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(NC(=O)C(O)c2ccccc2)cn1)C1CC1
InChIInChI=1S/C17H17N3O3/c21-15(11-4-2-1-3-5-11)17(23)19-13-8-9-14(18-10-13)20-16(22)12-6-7-12/h1-5,8-10,12,15,21H,6-7H2,(H,19,23)(H,18,20,22)
InChIKeyRUEJEZOYRKYMFF-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.10
Rot. Bonds5

About N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide

N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 91643425) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide
PubChem CID91643425
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC NameN-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(NC(=O)C(O)c2ccccc2)cn1)C1CC1
InChIInChI=1S/C17H17N3O3/c21-15(11-4-2-1-3-5-11)17(23)19-13-8-9-14(18-10-13)20-16(22)12-6-7-12/h1-5,8-10,12,15,21H,6-7H2,(H,19,23)(H,18,20,22)
InChIKeyRUEJEZOYRKYMFF-UHFFFAOYSA-N
XLogP2.10
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide
CID 56784483
N-[5-[[(2R)-2-(2-methylphenoxy)butanoyl]amino]-2-pyridinyl]cyclopropanecarboxamide
CID 97319750
N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542
N-[5-(3-aminopropanoylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 119879406
N-[5-(cyclopropylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 113023685
N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113027169
N-[6-(2-methylanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113016079
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113026538
N-(6-benzamido-3-pyridinyl)piperidine-4-carboxamide
CID 119893870
N-[5-[3-(2-aminophenyl)propanoylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 120613024
N-[5-(2,6-dichloroanilino)-2-pyridinyl]cyclopropanecarboxamide
CID 113036819
(2S)-2-hydroxy-2-phenyl-N-pyridin-3-ylacetamide
CID 118541599

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide (CID 91643425) is N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide is O=C(Nc1ccc(NC(=O)C(O)c2ccccc2)cn1)C1CC1.
What is the InChIKey of N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is RUEJEZOYRKYMFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c21-15(11-4-2-1-3-5-11)17(23)19-13-8-9-14(18-10-13)20-16(22)12-6-7-12/h1-5,8-10,12,15,21H,6-7H2,(H,19,23)(H,18,20,22).
What are the key properties of N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide?
N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 311.34 g/mol, XLogP of 2.10, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 91643425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).