(3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide

C24H26N4O4 — CID 25138268

IUPAC(3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide
SMILESO=C(N[C@@H]1CCOC[C@@H]1C(=O)NO)c1ccc(Cc2c(C3CC3)nc3ccccn23)cc1
InChIInChI=1S/C24H26N4O4/c29-23(25-19-10-12-32-14-18(19)24(30)27-31)17-6-4-15(5-7-17)13-20-22(16-8-9-16)26-21-3-1-2-11-28(20)21/h1-7,11,16,18-19,31H,8-10,12-14H2,(H,25,29)(H,27,30)/t18-,19+/m0/s1
InChIKeyFPQFSGNFLIZLQV-RBUKOAKNSA-N
MW434.50 g/mol
LogP2.44
Rot. Bonds6

About (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide

(3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide (PubChem CID 25138268) has the molecular formula C24H26N4O4 and a molecular weight of 434.50 g/mol. Its IUPAC name is (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide.

Molecular Properties

Compound Name(3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide
PubChem CID25138268
Molecular FormulaC24H26N4O4
Molecular Weight434.50 g/mol
Exact Mass434.20
IUPAC Name(3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide
SMILESO=C(N[C@@H]1CCOC[C@@H]1C(=O)NO)c1ccc(Cc2c(C3CC3)nc3ccccn23)cc1
InChIInChI=1S/C24H26N4O4/c29-23(25-19-10-12-32-14-18(19)24(30)27-31)17-6-4-15(5-7-17)13-20-22(16-8-9-16)26-21-3-1-2-11-28(20)21/h1-7,11,16,18-19,31H,8-10,12-14H2,(H,25,29)(H,27,30)/t18-,19+/m0/s1
InChIKeyFPQFSGNFLIZLQV-RBUKOAKNSA-N
XLogP2.44
TPSA104.96 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.50
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide?
The IUPAC name of (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide (CID 25138268) is (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide.
What is the SMILES notation for (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide?
The canonical SMILES for (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide is O=C(N[C@@H]1CCOC[C@@H]1C(=O)NO)c1ccc(Cc2c(C3CC3)nc3ccccn23)cc1.
What is the InChIKey of (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide?
The InChIKey is FPQFSGNFLIZLQV-RBUKOAKNSA-N. The full InChI is InChI=1S/C24H26N4O4/c29-23(25-19-10-12-32-14-18(19)24(30)27-31)17-6-4-15(5-7-17)13-20-22(16-8-9-16)26-21-3-1-2-11-28(20)21/h1-7,11,16,18-19,31H,8-10,12-14H2,(H,25,29)(H,27,30)/t18-,19+/m0/s1.
What are the key properties of (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide?
(3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide has a molecular weight of 434.50 g/mol, XLogP of 2.44, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-[[4-[(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)methyl]benzoyl]amino]-N-hydroxyoxane-3-carboxamide is sourced from PubChem (CID 25138268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).