2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide

C8H14N4O — CID 104619088

IUPAC2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
SMILESCNC(C)C(=O)Nc1[nH]ncc1C
InChIInChI=1S/C8H14N4O/c1-5-4-10-12-7(5)11-8(13)6(2)9-3/h4,6,9H,1-3H3,(H2,10,11,12,13)
InChIKeyGBRPCXSVXLTZHO-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.26
Rot. Bonds3

About 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide

2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide (PubChem CID 104619088) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound Name2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
PubChem CID104619088
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
SMILESCNC(C)C(=O)Nc1[nH]ncc1C
InChIInChI=1S/C8H14N4O/c1-5-4-10-12-7(5)11-8(13)6(2)9-3/h4,6,9H,1-3H3,(H2,10,11,12,13)
InChIKeyGBRPCXSVXLTZHO-UHFFFAOYSA-N
XLogP0.26
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea
CID 104620558
2-amino-N-(4-methyl-1H-pyrazol-5-yl)butanamide
CID 104618928
propan-2-yl N-(4-methyl-1H-pyrazol-5-yl)carbamate
CID 104620556
2-(aminomethyl)-4-methyl-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
CID 104618932
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
CID 104621851
2-amino-N-(4-methyl-1H-pyrazol-5-yl)pent-4-enamide
CID 104619019
N-(4-bromo-3,5-dimethylphenyl)-2-(methylamino)propanamide
CID 107574214
ethyl N-(4-methyl-1H-pyrazol-5-yl)carbamate
CID 115630334
6-amino-4-methyl-N-(4-methyl-1H-pyrazol-5-yl)hexanamide
CID 104619007
(2S)-2-(methylamino)-N-pyridin-4-ylpropanamide
CID 59361167
5-methyl-N-(4-methyl-1H-pyrazol-5-yl)furan-3-carboxamide
CID 114821900
N-(4-methyl-1H-pyrazol-5-yl)pyrrolidine-1-carboxamide
CID 104620563

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide?
The IUPAC name of 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide (CID 104619088) is 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide?
The canonical SMILES for 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide is CNC(C)C(=O)Nc1[nH]ncc1C.
What is the InChIKey of 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide?
The InChIKey is GBRPCXSVXLTZHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-5-4-10-12-7(5)11-8(13)6(2)9-3/h4,6,9H,1-3H3,(H2,10,11,12,13).
What are the key properties of 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide?
2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide has a molecular weight of 182.23 g/mol, XLogP of 0.26, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 104619088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).