1-amino-3-indazol-1-ylcyclohexane-1-carboxamide

C14H18N4O — CID 79637456

IUPAC1-amino-3-indazol-1-ylcyclohexane-1-carboxamide
SMILESNC(=O)C1(N)CCCC(n2ncc3ccccc32)C1
InChIInChI=1S/C14H18N4O/c15-13(19)14(16)7-3-5-11(8-14)18-12-6-2-1-4-10(12)9-17-18/h1-2,4,6,9,11H,3,5,7-8,16H2,(H2,15,19)
InChIKeyUQOAMFDOKQXFLV-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.33
Rot. Bonds2

About 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide

1-amino-3-indazol-1-ylcyclohexane-1-carboxamide (PubChem CID 79637456) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-indazol-1-ylcyclohexane-1-carboxamide
PubChem CID79637456
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name1-amino-3-indazol-1-ylcyclohexane-1-carboxamide
SMILESNC(=O)C1(N)CCCC(n2ncc3ccccc32)C1
InChIInChI=1S/C14H18N4O/c15-13(19)14(16)7-3-5-11(8-14)18-12-6-2-1-4-10(12)9-17-18/h1-2,4,6,9,11H,3,5,7-8,16H2,(H2,15,19)
InChIKeyUQOAMFDOKQXFLV-UHFFFAOYSA-N
XLogP1.33
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide?
The IUPAC name of 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide (CID 79637456) is 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide is NC(=O)C1(N)CCCC(n2ncc3ccccc32)C1.
What is the InChIKey of 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide?
The InChIKey is UQOAMFDOKQXFLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-13(19)14(16)7-3-5-11(8-14)18-12-6-2-1-4-10(12)9-17-18/h1-2,4,6,9,11H,3,5,7-8,16H2,(H2,15,19).
What are the key properties of 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide?
1-amino-3-indazol-1-ylcyclohexane-1-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-indazol-1-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 79637456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).