1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea

C11H13N5O2 — CID 47264478

IUPAC1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea
SMILESCOc1ncccc1NC(=O)Nc1cnn(C)c1
InChIInChI=1S/C11H13N5O2/c1-16-7-8(6-13-16)14-11(17)15-9-4-3-5-12-10(9)18-2/h3-7H,1-2H3,(H2,14,15,17)
InChIKeyJNCCJWVNWMDTES-UHFFFAOYSA-N
MW247.26 g/mol
LogP1.47
Rot. Bonds3

About 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea

1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea (PubChem CID 47264478) has the molecular formula C11H13N5O2 and a molecular weight of 247.26 g/mol. Its IUPAC name is 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea.

Molecular Properties

Compound Name1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea
PubChem CID47264478
Molecular FormulaC11H13N5O2
Molecular Weight247.26 g/mol
Exact Mass247.11
IUPAC Name1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea
SMILESCOc1ncccc1NC(=O)Nc1cnn(C)c1
InChIInChI=1S/C11H13N5O2/c1-16-7-8(6-13-16)14-11(17)15-9-4-3-5-12-10(9)18-2/h3-7H,1-2H3,(H2,14,15,17)
InChIKeyJNCCJWVNWMDTES-UHFFFAOYSA-N
XLogP1.47
TPSA81.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 100763708
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5-methoxy-2-[(1-methylpyrazol-4-yl)carbamoylamino]benzoic acid
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1-(2-methoxy-3-pyridinyl)-3-prop-2-ynylurea
CID 47042553
1-[1-[(2R)-3-(dimethylamino)-2-hydroxypropyl]pyrazol-4-yl]-3-(2-ethoxy-3-pyridinyl)urea
CID 95615911
1-(2-methoxy-3-pyridinyl)-3-[(1S)-1-(1-methylpyrrol-3-yl)ethyl]urea
CID 97021422
N-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
CID 47028121
1-(2-methoxyethyl)-3-(2-methoxy-3-pyridinyl)urea
CID 47223034
1-(2-methoxy-3-pyridinyl)-3-(2-methylpropyl)urea
CID 47042582
1-(2-methoxyphenyl)-3-[4-(1-methylpyrazol-4-yl)phenyl]urea
CID 72547993
1-(2-methoxy-3-pyridinyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea
CID 55744742
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CID 94796982

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea?
The IUPAC name of 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea (CID 47264478) is 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea.
What is the SMILES notation for 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea?
The canonical SMILES for 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea is COc1ncccc1NC(=O)Nc1cnn(C)c1.
What is the InChIKey of 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea?
The InChIKey is JNCCJWVNWMDTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O2/c1-16-7-8(6-13-16)14-11(17)15-9-4-3-5-12-10(9)18-2/h3-7H,1-2H3,(H2,14,15,17).
What are the key properties of 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea?
1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea has a molecular weight of 247.26 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-3-pyridinyl)-3-(1-methylpyrazol-4-yl)urea is sourced from PubChem (CID 47264478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).