1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea

C6H10N4O — CID 104620558

IUPAC1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea
SMILESCNC(=O)Nc1[nH]ncc1C
InChIInChI=1S/C6H10N4O/c1-4-3-8-10-5(4)9-6(11)7-2/h3H,1-2H3,(H3,7,8,9,10,11)
InChIKeyQEXVPDPKNFZLPG-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.47
Rot. Bonds1

About 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea

1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea (PubChem CID 104620558) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea.

Molecular Properties

Compound Name1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea
PubChem CID104620558
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea
SMILESCNC(=O)Nc1[nH]ncc1C
InChIInChI=1S/C6H10N4O/c1-4-3-8-10-5(4)9-6(11)7-2/h3H,1-2H3,(H3,7,8,9,10,11)
InChIKeyQEXVPDPKNFZLPG-UHFFFAOYSA-N
XLogP0.47
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
CID 104619088
1-(4-chlorophenyl)-3-(4-methyl-1H-pyrazol-5-yl)urea
CID 113238275
ethyl N-(4-methyl-1H-pyrazol-5-yl)carbamate
CID 115630334
1-amino-N-(4-methyl-1H-pyrazol-5-yl)cyclopentane-1-carboxamide
CID 104618942
propan-2-yl N-(4-methyl-1H-pyrazol-5-yl)carbamate
CID 104620556
N-(4-methyl-1H-pyrazol-5-yl)pyrrolidine-1-carboxamide
CID 104620563
2-(methylamino)-N-(4-methyl-1H-pyrazol-5-yl)benzamide
CID 104619425
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)butanamide
CID 104621856
2,5-dichloro-N-(4-methyl-1H-pyrazol-5-yl)benzamide
CID 112691317
N-(4-methyl-1H-pyrazol-5-yl)bicyclo[3.1.0]hexane-3-carboxamide
CID 104620156
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
CID 104621851
2-amino-N-(4-methyl-1H-pyrazol-5-yl)butanamide
CID 104618928

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea?
The IUPAC name of 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea (CID 104620558) is 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea.
What is the SMILES notation for 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea?
The canonical SMILES for 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea is CNC(=O)Nc1[nH]ncc1C.
What is the InChIKey of 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea?
The InChIKey is QEXVPDPKNFZLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-4-3-8-10-5(4)9-6(11)7-2/h3H,1-2H3,(H3,7,8,9,10,11).
What are the key properties of 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea?
1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea has a molecular weight of 154.17 g/mol, XLogP of 0.47, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(4-methyl-1H-pyrazol-5-yl)urea is sourced from PubChem (CID 104620558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).