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

C21H26N4O2 — CID 75767261

IUPAC5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
SMILESCn1nc(C(=O)NC2CCCc3ccccc32)cc1NC(=O)C1CCCC1
InChIInChI=1S/C21H26N4O2/c1-25-19(23-20(26)15-8-2-3-9-15)13-18(24-25)21(27)22-17-12-6-10-14-7-4-5-11-16(14)17/h4-5,7,11,13,15,17H,2-3,6,8-10,12H2,1H3,(H,22,27)(H,23,26)
InChIKeyWOYREGOLEVICPI-UHFFFAOYSA-N
MW366.47 g/mol
LogP3.36
Rot. Bonds4

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

5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide (PubChem CID 75767261) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
PubChem CID75767261
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
SMILESCn1nc(C(=O)NC2CCCc3ccccc32)cc1NC(=O)C1CCCC1
InChIInChI=1S/C21H26N4O2/c1-25-19(23-20(26)15-8-2-3-9-15)13-18(24-25)21(27)22-17-12-6-10-14-7-4-5-11-16(14)17/h4-5,7,11,13,15,17H,2-3,6,8-10,12H2,1H3,(H,22,27)(H,23,26)
InChIKeyWOYREGOLEVICPI-UHFFFAOYSA-N
XLogP3.36
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(cyclohexanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide
CID 75767268
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
3-methyl-4-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]phthalazine-1-carboxamide
CID 2677362
5-(cyclopentanecarbonylamino)-N-[2-(2-methoxyphenyl)ethyl]-1-methylpyrazole-3-carboxamide
CID 51999682
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl fluoride
CID 90147743
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

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
The IUPAC name of 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide (CID 75767261) is 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
The canonical SMILES for 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide is Cn1nc(C(=O)NC2CCCc3ccccc32)cc1NC(=O)C1CCCC1.
What is the InChIKey of 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
The InChIKey is WOYREGOLEVICPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-25-19(23-20(26)15-8-2-3-9-15)13-18(24-25)21(27)22-17-12-6-10-14-7-4-5-11-16(14)17/h4-5,7,11,13,15,17H,2-3,6,8-10,12H2,1H3,(H,22,27)(H,23,26).
What are the key properties of 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide?
5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopentanecarbonylamino)-1-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 75767261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).