N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide

C16H21N3O2 — CID 112829385

IUPACN-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NC3CCCC(C)C3)n[nH]2)o1
InChIInChI=1S/C16H21N3O2/c1-10-4-3-5-12(8-10)17-16(20)14-9-13(18-19-14)15-7-6-11(2)21-15/h6-7,9-10,12H,3-5,8H2,1-2H3,(H,17,20)(H,18,19)
InChIKeySVMGKJKTOVZREW-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.29
Rot. Bonds3

About N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide

N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide (PubChem CID 112829385) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
PubChem CID112829385
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NC3CCCC(C)C3)n[nH]2)o1
InChIInChI=1S/C16H21N3O2/c1-10-4-3-5-12(8-10)17-16(20)14-9-13(18-19-14)15-7-6-11(2)21-15/h6-7,9-10,12H,3-5,8H2,1-2H3,(H,17,20)(H,18,19)
InChIKeySVMGKJKTOVZREW-UHFFFAOYSA-N
XLogP3.29
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1R,3S)-3-[[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 120677392
N-(8-azabicyclo[3.2.1]octan-3-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 119459502
N-[2-(aminomethyl)cyclopentyl]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 119605177
N-(cyclopropylmethyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 166187750
N-[3-[[5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbonyl]amino]cyclobutyl]-4H-furo[3,2-b]pyrrole-5-carboxamide
CID 167985037
N-(2-aminoethyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride
CID 119385488
N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 166205740
N-[3-(methylamino)propyl]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide;hydrochloride
CID 119434158
N-cyclobutyl-5-methyl-1H-pyrazole-3-carboxamide
CID 126857183
5-cyclopropyl-N-[5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]-1H-pyrazole-3-carboxamide
CID 122151190
[4-(methylamino)piperidin-1-yl]-[5-(5-methylfuran-2-yl)-1H-pyrazol-3-yl]methanone
CID 119563954
5-(5-methylfuran-2-yl)-N-[2-(4-methylphenoxy)ethyl]-1H-pyrazole-3-carboxamide
CID 112828757

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide (CID 112829385) is N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide is Cc1ccc(-c2cc(C(=O)NC3CCCC(C)C3)n[nH]2)o1.
What is the InChIKey of N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
The InChIKey is SVMGKJKTOVZREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-10-4-3-5-12(8-10)17-16(20)14-9-13(18-19-14)15-7-6-11(2)21-15/h6-7,9-10,12H,3-5,8H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 3.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclohexyl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 112829385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).