1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide

C11H18N4O — CID 63820608

IUPAC1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
SMILESCc1cc(NC(=O)C2(N)CCCCC2)n[nH]1
InChIInChI=1S/C11H18N4O/c1-8-7-9(15-14-8)13-10(16)11(12)5-3-2-4-6-11/h7H,2-6,12H2,1H3,(H2,13,14,15,16)
InChIKeyHKAPFWYYKDSWER-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.32
Rot. Bonds2

About 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide

1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide (PubChem CID 63820608) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
PubChem CID63820608
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
SMILESCc1cc(NC(=O)C2(N)CCCCC2)n[nH]1
InChIInChI=1S/C11H18N4O/c1-8-7-9(15-14-8)13-10(16)11(12)5-3-2-4-6-11/h7H,2-6,12H2,1H3,(H2,13,14,15,16)
InChIKeyHKAPFWYYKDSWER-UHFFFAOYSA-N
XLogP1.32
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(5-ethyl-1H-pyrazol-3-yl)-1-methylcyclopentane-1-carboxamide
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CID 104618529
1-amino-N-[4-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]-4,8-dihydroimidazo[1,2-a]pyrazin-4-ium-7-yl]sulfanyl]phenyl]cyclopentane-1-carboxamide
CID 173087144
1-amino-N-(2-methyl-1H-indol-5-yl)cyclohexane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide (CID 63820608) is 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide is Cc1cc(NC(=O)C2(N)CCCCC2)n[nH]1.
What is the InChIKey of 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide?
The InChIKey is HKAPFWYYKDSWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8-7-9(15-14-8)13-10(16)11(12)5-3-2-4-6-11/h7H,2-6,12H2,1H3,(H2,13,14,15,16).
What are the key properties of 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide?
1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.32, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 63820608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).