N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide

C10H17N3O — CID 170982015

IUPACN-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide
SMILESCC(C)CNC(=O)CCc1ccn[nH]1
InChIInChI=1S/C10H17N3O/c1-8(2)7-11-10(14)4-3-9-5-6-12-13-9/h5-6,8H,3-4,7H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyXFWCPDILMVUWQL-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.11
Rot. Bonds5

About N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide

N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide (PubChem CID 170982015) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide
PubChem CID170982015
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide
SMILESCC(C)CNC(=O)CCc1ccn[nH]1
InChIInChI=1S/C10H17N3O/c1-8(2)7-11-10(14)4-3-9-5-6-12-13-9/h5-6,8H,3-4,7H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyXFWCPDILMVUWQL-UHFFFAOYSA-N
XLogP1.11
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-4-methylpentyl)-2-(1H-pyrazol-5-yl)acetamide
CID 103770935
3-(1H-pyrazol-5-yl)propanoic acid;hydrobromide
CID 175345589
(4R)-4-(4-methylpiperazin-1-yl)-N-[2-(1H-pyrazol-5-yl)ethyl]pentanamide
CID 125441014
2-ethyl-N-[2-(1H-pyrazol-5-yl)ethyl]butanamide
CID 110731759
N-(4-methyl-3-pyridinyl)-3-(1H-pyrazol-5-yl)propanamide
CID 156907188
N-(3-ethyl-2-hydroxypentyl)-2-(1H-pyrazol-5-yl)acetamide
CID 111477485
3-(4-aminophenyl)-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 61284267
3-chloro-2-methyl-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 62728534
3-(2-methylphenyl)-N-(2-methylpropyl)propanamide
CID 63283832
4-amino-N-(1H-pyrazol-5-ylmethyl)butanamide
CID 61285698
6-oxo-6-(1H-pyrazol-5-ylmethylamino)hexanoic acid
CID 61286078
N-propan-2-yl-2-(1H-pyrazol-5-ylmethylamino)acetamide
CID 43662596

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide?
The IUPAC name of N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide (CID 170982015) is N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide?
The canonical SMILES for N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide is CC(C)CNC(=O)CCc1ccn[nH]1.
What is the InChIKey of N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide?
The InChIKey is XFWCPDILMVUWQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8(2)7-11-10(14)4-3-9-5-6-12-13-9/h5-6,8H,3-4,7H2,1-2H3,(H,11,14)(H,12,13).
What are the key properties of N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide?
N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide has a molecular weight of 195.27 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-3-(1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 170982015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).