1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea

C14H19N5O2 — CID 86793478

IUPAC1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea
SMILESCOc1ccc(C)nc1NC(=O)NCCn1cc(C)cn1
InChIInChI=1S/C14H19N5O2/c1-10-8-16-19(9-10)7-6-15-14(20)18-13-12(21-3)5-4-11(2)17-13/h4-5,8-9H,6-7H2,1-3H3,(H2,15,17,18,20)
InChIKeyWNNKWCWXCSOICX-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.73
Rot. Bonds5

About 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea

1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea (PubChem CID 86793478) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea.

Molecular Properties

Compound Name1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea
PubChem CID86793478
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea
SMILESCOc1ccc(C)nc1NC(=O)NCCn1cc(C)cn1
InChIInChI=1S/C14H19N5O2/c1-10-8-16-19(9-10)7-6-15-14(20)18-13-12(21-3)5-4-11(2)17-13/h4-5,8-9H,6-7H2,1-3H3,(H2,15,17,18,20)
InChIKeyWNNKWCWXCSOICX-UHFFFAOYSA-N
XLogP1.73
TPSA81.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(4-methylpyrazol-1-yl)ethyl]-3-(6-methyl-2-pyridinyl)urea
CID 75507984
1-[4-(2-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-3-[3-(4-methylpyrazol-1-yl)propyl]urea
CID 118792010
2-methyl-2-[2-(4-methylpyrazol-1-yl)ethylcarbamoylamino]propanoic acid
CID 113363990
N-(5-amino-2-methoxyphenyl)-3-(4-methylpyrazol-1-yl)propanamide
CID 60874213
2-methoxy-5-methyl-N-[2-(4-methylpyrazol-1-yl)ethyl]benzenesulfonamide
CID 99843579
(2S)-2-hydroxy-4-[2-(4-methylpyrazol-1-yl)ethylcarbamoylamino]butanoic acid
CID 114131625
(1R)-1-(2-methoxy-5-methylphenyl)-2-[2-(4-methylpyrazol-1-yl)ethylamino]ethanol
CID 95350933
2-chloro-N-[2-(4-methylpyrazol-1-yl)ethyl]propanamide
CID 103881624
2-chloro-N-[2-(4-methylpyrazol-1-yl)ethyl]-2-phenylacetamide
CID 114130254
N-[(2,5-dimethoxyphenyl)methyl]-2-(4-methylpyrazol-1-yl)ethanamine
CID 103649568
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methylpyrazol-1-yl)ethanamine
CID 103650750
1-(2,4-dimethoxyphenyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]ethanamine
CID 103871912

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea?
The IUPAC name of 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea (CID 86793478) is 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea.
What is the SMILES notation for 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea?
The canonical SMILES for 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea is COc1ccc(C)nc1NC(=O)NCCn1cc(C)cn1.
What is the InChIKey of 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea?
The InChIKey is WNNKWCWXCSOICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-10-8-16-19(9-10)7-6-15-14(20)18-13-12(21-3)5-4-11(2)17-13/h4-5,8-9H,6-7H2,1-3H3,(H2,15,17,18,20).
What are the key properties of 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea?
1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea has a molecular weight of 289.34 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxy-6-methyl-2-pyridinyl)-3-[2-(4-methylpyrazol-1-yl)ethyl]urea is sourced from PubChem (CID 86793478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).