N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide

C19H25N3O2 — CID 22510243

IUPACN-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide
SMILESCc1nn(C(=O)CCCC(=O)NC2CCCCC2)c2ccccc12
InChIInChI=1S/C19H25N3O2/c1-14-16-10-5-6-11-17(16)22(21-14)19(24)13-7-12-18(23)20-15-8-3-2-4-9-15/h5-6,10-11,15H,2-4,7-9,12-13H2,1H3,(H,20,23)
InChIKeyOVCJQPLQVOQJIK-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.60
Rot. Bonds5

About N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide

N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide (PubChem CID 22510243) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide
PubChem CID22510243
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide
SMILESCc1nn(C(=O)CCCC(=O)NC2CCCCC2)c2ccccc12
InChIInChI=1S/C19H25N3O2/c1-14-16-10-5-6-11-17(16)22(21-14)19(24)13-7-12-18(23)20-15-8-3-2-4-9-15/h5-6,10-11,15H,2-4,7-9,12-13H2,1H3,(H,20,23)
InChIKeyOVCJQPLQVOQJIK-UHFFFAOYSA-N
XLogP3.60
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-ethoxyphenyl)methyl]-5-(3-methylindazol-1-yl)-5-oxopentanamide
CID 22510284
N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide
CID 22509795
N-cyclooctyl-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 51179223
N-cyclooctyl-5-oxo-5-phenylpentanamide
CID 20969095
N-cyclopentyl-5-[1-[2-(cyclopentylamino)-2-oxoethyl]-2,4-dioxoquinazolin-3-yl]pentanamide
CID 3235637
N-cyclopentyl-4-(2-ethoxyphenoxy)butanamide
CID 78781833
N-cyclohexyl-4-(9-phenyl-2,4,5,7,8,10-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,8,10,12,14-heptaen-3-yl)butanamide
CID 20874875
N-cyclohexyl-4-[3-(2-methylbenzimidazol-1-yl)propanoylamino]piperidine-1-carboxamide
CID 131897369
N-cyclopropyl-4-[(4-methylphthalazin-1-yl)amino]butanamide
CID 112730869
N-cyclooctylbutanamide
CID 4614062
N-cyclohexyl-4-(2-pyridin-2-yl-1H-indol-3-yl)butanamide
CID 18827474
N-cyclopentyl-4-(2,4-dioxo-1-phenacylquinazolin-3-yl)butanamide
CID 6619275

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide?
The IUPAC name of N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide (CID 22510243) is N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide.
What is the SMILES notation for N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide?
The canonical SMILES for N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide is Cc1nn(C(=O)CCCC(=O)NC2CCCCC2)c2ccccc12.
What is the InChIKey of N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide?
The InChIKey is OVCJQPLQVOQJIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14-16-10-5-6-11-17(16)22(21-14)19(24)13-7-12-18(23)20-15-8-3-2-4-9-15/h5-6,10-11,15H,2-4,7-9,12-13H2,1H3,(H,20,23).
What are the key properties of N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide?
N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide has a molecular weight of 327.43 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide is sourced from PubChem (CID 22510243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).