4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide

C19H24N4O4 — CID 118714259

IUPAC4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide
SMILESCOc1ccccc1C(=O)Nc1cn[nH]c1C(=O)NC1CCC(OC)CC1
InChIInChI=1S/C19H24N4O4/c1-26-13-9-7-12(8-10-13)21-19(25)17-15(11-20-23-17)22-18(24)14-5-3-4-6-16(14)27-2/h3-6,11-13H,7-10H2,1-2H3,(H,20,23)(H,21,25)(H,22,24)
InChIKeyGCKUEWBVSJWQMM-UHFFFAOYSA-N
MW372.43 g/mol
LogP2.36
Rot. Bonds6

About 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide

4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide (PubChem CID 118714259) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide
PubChem CID118714259
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC Name4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide
SMILESCOc1ccccc1C(=O)Nc1cn[nH]c1C(=O)NC1CCC(OC)CC1
InChIInChI=1S/C19H24N4O4/c1-26-13-9-7-12(8-10-13)21-19(25)17-15(11-20-23-17)22-18(24)14-5-3-4-6-16(14)27-2/h3-6,11-13H,7-10H2,1-2H3,(H,20,23)(H,21,25)(H,22,24)
InChIKeyGCKUEWBVSJWQMM-UHFFFAOYSA-N
XLogP2.36
TPSA105.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide (CID 118714259) is 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide is COc1ccccc1C(=O)Nc1cn[nH]c1C(=O)NC1CCC(OC)CC1.
What is the InChIKey of 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide?
The InChIKey is GCKUEWBVSJWQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-26-13-9-7-12(8-10-13)21-19(25)17-15(11-20-23-17)22-18(24)14-5-3-4-6-16(14)27-2/h3-6,11-13H,7-10H2,1-2H3,(H,20,23)(H,21,25)(H,22,24).
What are the key properties of 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide?
4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 2.36, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxybenzoyl)amino]-N-(4-methoxycyclohexyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 118714259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).