N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide

C11H17N3O — CID 55028096

IUPACN-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
SMILESCc1cc(C)n(CC(=O)NCC2CC2)n1
InChIInChI=1S/C11H17N3O/c1-8-5-9(2)14(13-8)7-11(15)12-6-10-3-4-10/h5,10H,3-4,6-7H2,1-2H3,(H,12,15)
InChIKeyCCNUSPREHFYABE-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.03
Rot. Bonds4

About N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide

N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide (PubChem CID 55028096) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
PubChem CID55028096
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
SMILESCc1cc(C)n(CC(=O)NCC2CC2)n1
InChIInChI=1S/C11H17N3O/c1-8-5-9(2)14(13-8)7-11(15)12-6-10-3-4-10/h5,10H,3-4,6-7H2,1-2H3,(H,12,15)
InChIKeyCCNUSPREHFYABE-UHFFFAOYSA-N
XLogP1.03
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-dimethylpyrazol-1-yl)-N-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]acetamide
CID 95220651
2-(3,5-dimethylpyrazol-1-yl)-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]acetamide
CID 51595414
2-(3,5-dimethylpyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 573590
N-[3-(cyclopropylamino)propyl]-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 43648264
N-(azetidin-3-yl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 66185586
2-(3,5-dimethylpyrazol-1-yl)-N-(2-sulfanylethyl)acetamide
CID 19525804
2-(3,5-dimethylpyrazol-1-yl)-N-[2-(methylamino)ethyl]acetamide
CID 62659650
2-(3,5-dimethylpyrazol-1-yl)-N-[(1-hydroxy-4-methylcyclohexyl)methyl]acetamide
CID 65119104
2-(3,5-dimethylpyrazol-1-yl)-N-(3-trimethoxysilylpropyl)acetamide
CID 156761758
N-(2-aminopropyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 63733136
2-(3,5-dimethylpyrazol-1-yl)-N-(3-hydroxy-2-methylpropyl)acetamide
CID 65037208
methyl (E)-4-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]but-2-enoate
CID 118667802

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide (CID 55028096) is N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide is Cc1cc(C)n(CC(=O)NCC2CC2)n1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide?
The InChIKey is CCNUSPREHFYABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-5-9(2)14(13-8)7-11(15)12-6-10-3-4-10/h5,10H,3-4,6-7H2,1-2H3,(H,12,15).
What are the key properties of N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide?
N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide has a molecular weight of 207.28 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide is sourced from PubChem (CID 55028096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).