N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide

C23H20N4O2 — CID 21369028

IUPACN-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide
SMILESCc1n[nH]c(C)c1NC(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C23H20N4O2/c1-14-21(15(2)27-26-14)25-22(28)17-10-12-18(13-11-17)24-23(29)20-9-5-7-16-6-3-4-8-19(16)20/h3-13H,1-2H3,(H,24,29)(H,25,28)(H,26,27)
InChIKeyKTDZKVQFJGRYOC-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.68
Rot. Bonds4

About N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide

N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide (PubChem CID 21369028) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide
PubChem CID21369028
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC NameN-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide
SMILESCc1n[nH]c(C)c1NC(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C23H20N4O2/c1-14-21(15(2)27-26-14)25-22(28)17-10-12-18(13-11-17)24-23(29)20-9-5-7-16-6-3-4-8-19(16)20/h3-13H,1-2H3,(H,24,29)(H,25,28)(H,26,27)
InChIKeyKTDZKVQFJGRYOC-UHFFFAOYSA-N
XLogP4.68
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2-methylphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 2988389
N-(3,5-dimethyl-1H-pyrazol-4-yl)naphthalene-2-carboxamide
CID 43399081
(2-naphthalen-1-yl-2-oxoethyl) 4-[(4-methylbenzoyl)amino]benzoate
CID 126184955
N-[4-(2-methylbutan-2-ylcarbamoyl)phenyl]naphthalene-1-carboxamide
CID 60533340
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(propylamino)benzamide
CID 62167844
N-[6-(4-benzamidophenyl)-3-pyridinyl]naphthalene-1-carboxamide
CID 170422622
6-[4-(naphthalene-1-carbonylamino)phenyl]-N-phenylpyridine-3-carboxamide
CID 170421908
N-(3,5-dimethyl-1H-pyrazol-4-yl)-6-(methylamino)pyridine-3-carboxamide
CID 62168366
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide
CID 21369133
N-(4-iodophenyl)naphthalene-1-carboxamide
CID 1019200
N-[3-(naphthalene-1-carbonylamino)phenyl]pyridine-4-carboxamide
CID 55610557
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-fluorobenzamide
CID 62662395

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide (CID 21369028) is N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide is Cc1n[nH]c(C)c1NC(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide?
The InChIKey is KTDZKVQFJGRYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-14-21(15(2)27-26-14)25-22(28)17-10-12-18(13-11-17)24-23(29)20-9-5-7-16-6-3-4-8-19(16)20/h3-13H,1-2H3,(H,24,29)(H,25,28)(H,26,27).
What are the key properties of N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide?
N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.68, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 21369028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).