N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide

C19H18N4O3 — CID 127026648

IUPACN-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1n[nH]c2ccccc12
InChIInChI=1S/C19H18N4O3/c24-18(17-15-3-1-2-4-16(15)21-22-17)20-14-7-5-13(6-8-14)19(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,20,24)(H,21,22)
InChIKeyCRDYPNWZKBQDRV-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.29
Rot. Bonds3

About N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide

N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide (PubChem CID 127026648) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide
PubChem CID127026648
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC NameN-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1n[nH]c2ccccc12
InChIInChI=1S/C19H18N4O3/c24-18(17-15-3-1-2-4-16(15)21-22-17)20-14-7-5-13(6-8-14)19(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,20,24)(H,21,22)
InChIKeyCRDYPNWZKBQDRV-UHFFFAOYSA-N
XLogP2.29
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide (CID 127026648) is N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide is O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1n[nH]c2ccccc12.
What is the InChIKey of N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide?
The InChIKey is CRDYPNWZKBQDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c24-18(17-15-3-1-2-4-16(15)21-22-17)20-14-7-5-13(6-8-14)19(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,20,24)(H,21,22).
What are the key properties of N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide?
N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide has a molecular weight of 350.38 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(morpholine-4-carbonyl)phenyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 127026648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).