1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea

C10H15N3O2 — CID 134178395

IUPAC1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea
SMILESCONC(=O)Nc1ncccc1C(C)C
InChIInChI=1S/C10H15N3O2/c1-7(2)8-5-4-6-11-9(8)12-10(14)13-15-3/h4-7H,1-3H3,(H2,11,12,13,14)
InChIKeyFXPPMNCZFWLKAN-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.89
Rot. Bonds3

About 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea

1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea (PubChem CID 134178395) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea.

Molecular Properties

Compound Name1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea
PubChem CID134178395
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea
SMILESCONC(=O)Nc1ncccc1C(C)C
InChIInChI=1S/C10H15N3O2/c1-7(2)8-5-4-6-11-9(8)12-10(14)13-15-3/h4-7H,1-3H3,(H2,11,12,13,14)
InChIKeyFXPPMNCZFWLKAN-UHFFFAOYSA-N
XLogP1.89
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(3-propan-2-yl-2-pyridinyl)amino]butanamide
CID 144912549
1-(3-phenylmethoxy-2-pyridinyl)-3-(2-propan-2-ylphenyl)urea
CID 11501398
ethane;2-methoxy-3-propan-2-ylpyridine
CID 155741549
methyl (2R)-2-[(R)-[2-(2,2-dimethylpropanoylamino)-3-pyridinyl]-hydroxymethyl]-3,3-dimethylbutanoate
CID 129392250
tert-butyl N-[3-[(1S)-1-bromoethyl]-2-pyridinyl]carbamate
CID 125458489
N'-(3-methyl-2-pyridinyl)-N-(2-propan-2-ylphenyl)oxamide
CID 108500634
1-(4-fluoro-2-propan-2-ylphenyl)-3-methoxyurea
CID 134177615
1-(3-chloro-2-pyridinyl)-3-propan-2-ylurea
CID 103886204
methyl 2-[(3-chloro-2-pyridinyl)amino]propanoate
CID 43515165
methyl 2-hydroxy-2-(2-methyl-3-pyridinyl)acetate
CID 57017613
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)propanamide
CID 103630280
2-(methylcarbamoylamino)pyridine-3-carboxamide
CID 88995807

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea?
The IUPAC name of 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea (CID 134178395) is 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea.
What is the SMILES notation for 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea?
The canonical SMILES for 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea is CONC(=O)Nc1ncccc1C(C)C.
What is the InChIKey of 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea?
The InChIKey is FXPPMNCZFWLKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7(2)8-5-4-6-11-9(8)12-10(14)13-15-3/h4-7H,1-3H3,(H2,11,12,13,14).
What are the key properties of 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea?
1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea has a molecular weight of 209.25 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(3-propan-2-yl-2-pyridinyl)urea is sourced from PubChem (CID 134178395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).