N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide

C18H25N3O — CID 22509795

IUPACN-cycloheptyl-2-(3-methylindazol-1-yl)propanamide
SMILESCc1nn(C(C)C(=O)NC2CCCCCC2)c2ccccc12
InChIInChI=1S/C18H25N3O/c1-13-16-11-7-8-12-17(16)21(20-13)14(2)18(22)19-15-9-5-3-4-6-10-15/h7-8,11-12,14-15H,3-6,9-10H2,1-2H3,(H,19,22)
InChIKeyGWDLJRRCTOOQIR-UHFFFAOYSA-N
MW299.42 g/mol
LogP3.74
Rot. Bonds3

About N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide

N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide (PubChem CID 22509795) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(3-methylindazol-1-yl)propanamide
PubChem CID22509795
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC NameN-cycloheptyl-2-(3-methylindazol-1-yl)propanamide
SMILESCc1nn(C(C)C(=O)NC2CCCCCC2)c2ccccc12
InChIInChI=1S/C18H25N3O/c1-13-16-11-7-8-12-17(16)21(20-13)14(2)18(22)19-15-9-5-3-4-6-10-15/h7-8,11-12,14-15H,3-6,9-10H2,1-2H3,(H,19,22)
InChIKeyGWDLJRRCTOOQIR-UHFFFAOYSA-N
XLogP3.74
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylindazol-1-yl)-N-propan-2-ylpropanamide
CID 22509793
N-cyclohexyl-2-(1-oxo-4-phenylphthalazin-2-yl)propanamide
CID 11291808
3-[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]-4-oxophthalazine-1-carboxylate
CID 2627397
2-(3-methylindazol-1-yl)-N-(3-phenylpropyl)propanamide
CID 3342931
N-cyclohexyl-5-(3-methylindazol-1-yl)-5-oxopentanamide
CID 22510243
N-cycloheptyl-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6-yl)propanamide
CID 5075450
N-[(4-methoxyphenyl)methyl]-2-(3-methylindazol-1-yl)propanamide
CID 3342933
N-cyclopentyl-2-(3-methylpyrazol-1-yl)propanamide
CID 19534188
2-(4-chloro-5-methylpyrazol-1-yl)-N-cyclohexylpropanamide
CID 19533698
2-(4-bromo-3-methylpyrazol-1-yl)-N-cyclooctylpropanamide
CID 45125859
N-cyclooctyl-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 51179223
N-cyclopentyl-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide
CID 4772164

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide?
The IUPAC name of N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide (CID 22509795) is N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide.
What is the SMILES notation for N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide?
The canonical SMILES for N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide is Cc1nn(C(C)C(=O)NC2CCCCCC2)c2ccccc12.
What is the InChIKey of N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide?
The InChIKey is GWDLJRRCTOOQIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O/c1-13-16-11-7-8-12-17(16)21(20-13)14(2)18(22)19-15-9-5-3-4-6-10-15/h7-8,11-12,14-15H,3-6,9-10H2,1-2H3,(H,19,22).
What are the key properties of N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide?
N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide has a molecular weight of 299.42 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(3-methylindazol-1-yl)propanamide is sourced from PubChem (CID 22509795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).