5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide

C22H28N4O2 — CID 75767268

IUPAC5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
SMILESCn1nc(C(=O)NC2CCCc3ccccc32)cc1NC(=O)C1CCCCC1
InChIInChI=1S/C22H28N4O2/c1-26-20(24-21(27)16-9-3-2-4-10-16)14-19(25-26)22(28)23-18-13-7-11-15-8-5-6-12-17(15)18/h5-6,8,12,14,16,18H,2-4,7,9-11,13H2,1H3,(H,23,28)(H,24,27)
InChIKeyVENSVIQDRAZIEZ-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.75
Rot. Bonds4

About 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide

5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide (PubChem CID 75767268) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
PubChem CID75767268
Molecular FormulaC22H28N4O2
Molecular Weight380.49 g/mol
Exact Mass380.22
IUPAC Name5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
SMILESCn1nc(C(=O)NC2CCCc3ccccc32)cc1NC(=O)C1CCCCC1
InChIInChI=1S/C22H28N4O2/c1-26-20(24-21(27)16-9-3-2-4-10-16)14-19(25-26)22(28)23-18-13-7-11-15-8-5-6-12-17(15)18/h5-6,8,12,14,16,18H,2-4,7,9-11,13H2,1H3,(H,23,28)(H,24,27)
InChIKeyVENSVIQDRAZIEZ-UHFFFAOYSA-N
XLogP3.75
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
CID 75767261
1-methyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-3-carboxamide
CID 35324690
5-(cyclohexanecarbonylamino)-1-methyl-N-(2-phenylethyl)pyrazole-3-carboxamide
CID 51999785
5-(cyclopentanecarbonylamino)-1-methyl-N-propan-2-ylpyrazole-3-carboxamide
CID 51999563
5-(cyclopentanecarbonylamino)-1-methyl-N-(thian-4-yl)pyrazole-3-carboxamide
CID 51999688
1,3,5-trimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-4-carboxamide
CID 45148404
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cyclopropanecarboxamide
CID 7688429
5-(cyclopentanecarbonylamino)-1-methyl-N-(2-methylpropyl)pyrazole-3-carboxamide
CID 51999568
5-(cyclohexanecarbonylamino)-1-methyl-N-[(1-methylbenzimidazol-2-yl)methyl]pyrazole-3-carboxamide
CID 51999832
6-N-cycloheptyl-5,6-dimethyl-4-oxo-2-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
CID 50758477
3-methyl-4-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]phthalazine-1-carboxamide
CID 2677362
2-(cyclohexanecarbonylamino)-N-(2,3-dihydro-1H-inden-1-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 87544054

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
The IUPAC name of 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide (CID 75767268) is 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
The canonical SMILES for 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide is Cn1nc(C(=O)NC2CCCc3ccccc32)cc1NC(=O)C1CCCCC1.
What is the InChIKey of 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
The InChIKey is VENSVIQDRAZIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O2/c1-26-20(24-21(27)16-9-3-2-4-10-16)14-19(25-26)22(28)23-18-13-7-11-15-8-5-6-12-17(15)18/h5-6,8,12,14,16,18H,2-4,7,9-11,13H2,1H3,(H,23,28)(H,24,27).
What are the key properties of 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 3.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 75767268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).