N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide

C17H23N3O — CID 19555806

IUPACN-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide
SMILESCCC(NC(=O)CCn1ccc(C)n1)c1ccc(C)cc1
InChIInChI=1S/C17H23N3O/c1-4-16(15-7-5-13(2)6-8-15)18-17(21)10-12-20-11-9-14(3)19-20/h5-9,11,16H,4,10,12H2,1-3H3,(H,18,21)
InChIKeyYHWLUMHVJLSVKD-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.16
Rot. Bonds6

About N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide

N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide (PubChem CID 19555806) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide
PubChem CID19555806
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide
SMILESCCC(NC(=O)CCn1ccc(C)n1)c1ccc(C)cc1
InChIInChI=1S/C17H23N3O/c1-4-16(15-7-5-13(2)6-8-15)18-17(21)10-12-20-11-9-14(3)19-20/h5-9,11,16H,4,10,12H2,1-3H3,(H,18,21)
InChIKeyYHWLUMHVJLSVKD-UHFFFAOYSA-N
XLogP3.16
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methylphenyl)propyl]-2-(3-methylpyrazol-1-yl)acetamide
CID 19516870
3-(4-bromo-3-nitropyrazol-1-yl)-N-[1-(4-methylphenyl)propyl]propanamide
CID 19567782
N-[1-(4-methylphenyl)propyl]-2-(3-methylpyrazol-1-yl)propanamide
CID 19536949
N-(2-methylbutan-2-yl)-3-(3-methylpyrazol-1-yl)propanamide
CID 45106808
1-methyl-N-[1-(4-methylphenyl)propyl]-6-oxopyridazine-3-carboxamide
CID 78777843
5-amino-N-[1-(4-methylphenyl)propyl]hexanamide
CID 82848237
2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(1S)-1-(4-methylphenyl)propyl]acetamide
CID 7977562
2-methoxy-N-[(1S)-1-(4-methylphenyl)propyl]acetamide
CID 94014639
3-(3-methylpyrazol-1-yl)-N-(2,3,4,5,6-pentafluorophenyl)propanamide
CID 19555789
N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-3-(3-methylpyrazol-1-yl)propanamide
CID 19555925
2-(4-chloropyrazol-1-yl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 19584605
N-[(1R)-1-(4-methylphenyl)propyl]-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamide
CID 7465586

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide (CID 19555806) is N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide is CCC(NC(=O)CCn1ccc(C)n1)c1ccc(C)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide?
The InChIKey is YHWLUMHVJLSVKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-4-16(15-7-5-13(2)6-8-15)18-17(21)10-12-20-11-9-14(3)19-20/h5-9,11,16H,4,10,12H2,1-3H3,(H,18,21).
What are the key properties of N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide?
N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide has a molecular weight of 285.39 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)propyl]-3-(3-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19555806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).