(4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide

C18H16ClN5O2 — CID 162509780

IUPAC(4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide
SMILESO=C1NC[C@@H](C(=O)NC(c2ccc(Cl)cc2)c2ccn3nccc3c2)N1
InChIInChI=1S/C18H16ClN5O2/c19-13-3-1-11(2-4-13)16(23-17(25)15-10-20-18(26)22-15)12-6-8-24-14(9-12)5-7-21-24/h1-9,15-16H,10H2,(H,23,25)(H2,20,22,26)/t15-,16?/m0/s1
InChIKeyFVOJLDIQWLGJCG-VYRBHSGPSA-N
MW369.81 g/mol
LogP1.87
Rot. Bonds4

About (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide

(4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide (PubChem CID 162509780) has the molecular formula C18H16ClN5O2 and a molecular weight of 369.81 g/mol. Its IUPAC name is (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound Name(4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide
PubChem CID162509780
Molecular FormulaC18H16ClN5O2
Molecular Weight369.81 g/mol
Exact Mass369.10
IUPAC Name(4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide
SMILESO=C1NC[C@@H](C(=O)NC(c2ccc(Cl)cc2)c2ccn3nccc3c2)N1
InChIInChI=1S/C18H16ClN5O2/c19-13-3-1-11(2-4-13)16(23-17(25)15-10-20-18(26)22-15)12-6-8-24-14(9-12)5-7-21-24/h1-9,15-16H,10H2,(H,23,25)(H2,20,22,26)/t15-,16?/m0/s1
InChIKeyFVOJLDIQWLGJCG-VYRBHSGPSA-N
XLogP1.87
TPSA87.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.81
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide?
The IUPAC name of (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide (CID 162509780) is (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide is O=C1NC[C@@H](C(=O)NC(c2ccc(Cl)cc2)c2ccn3nccc3c2)N1.
What is the InChIKey of (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide?
The InChIKey is FVOJLDIQWLGJCG-VYRBHSGPSA-N. The full InChI is InChI=1S/C18H16ClN5O2/c19-13-3-1-11(2-4-13)16(23-17(25)15-10-20-18(26)22-15)12-6-8-24-14(9-12)5-7-21-24/h1-9,15-16H,10H2,(H,23,25)(H2,20,22,26)/t15-,16?/m0/s1.
What are the key properties of (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide?
(4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide has a molecular weight of 369.81 g/mol, XLogP of 1.87, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-[(4-chlorophenyl)-pyrazolo[1,5-a]pyridin-5-ylmethyl]-2-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 162509780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).