1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea

C10H15N3O2 — CID 51264614

IUPAC1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea
SMILESCOCC(C)NC(=O)Nc1cccnc1
InChIInChI=1S/C10H15N3O2/c1-8(7-15-2)12-10(14)13-9-4-3-5-11-6-9/h3-6,8H,7H2,1-2H3,(H2,12,13,14)
InChIKeyOJUKWNAVSQIJRP-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.24
Rot. Bonds4

About 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea

1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea (PubChem CID 51264614) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea.

Molecular Properties

Compound Name1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea
PubChem CID51264614
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea
SMILESCOCC(C)NC(=O)Nc1cccnc1
InChIInChI=1S/C10H15N3O2/c1-8(7-15-2)12-10(14)13-9-4-3-5-11-6-9/h3-6,8H,7H2,1-2H3,(H2,12,13,14)
InChIKeyOJUKWNAVSQIJRP-UHFFFAOYSA-N
XLogP1.24
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[amino-(1-methoxypropan-2-ylamino)methylidene]amino]-N-pyridin-3-ylacetamide;hydroiodide
CID 111093023
5-methoxy-2-(pyridin-3-ylcarbamoylamino)pentanoic acid
CID 81086092
2-[[ethylamino-(1-methoxypropan-2-ylamino)methylidene]amino]-N-pyridin-3-ylacetamide
CID 111234473
1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea
CID 47172008
1-[(2S)-1-methoxypropan-2-yl]-3-(4-pyridin-4-yloxyphenyl)urea
CID 95121864
1-(3-chlorophenyl)-3-(1-methoxypropan-2-yl)urea
CID 24528797
4-methyl-2-(pyridin-3-ylcarbamoylamino)pentanoic acid
CID 61187819
1-(3-ethynylphenyl)-3-[(2S)-1-methoxypropan-2-yl]urea
CID 94812290
1-[(1R)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-3-pyridin-3-ylurea
CID 97185687
1-(7-methyloctan-3-yl)-3-pyridin-3-ylurea
CID 167246935
1-[(2R)-1-methoxypropan-2-yl]-3-(3-nitrophenyl)urea
CID 27870478
1-benzhydryl-3-pyridin-3-ylurea
CID 108864958

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea?
The IUPAC name of 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea (CID 51264614) is 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea.
What is the SMILES notation for 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea?
The canonical SMILES for 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea is COCC(C)NC(=O)Nc1cccnc1.
What is the InChIKey of 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea?
The InChIKey is OJUKWNAVSQIJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8(7-15-2)12-10(14)13-9-4-3-5-11-6-9/h3-6,8H,7H2,1-2H3,(H2,12,13,14).
What are the key properties of 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea?
1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea has a molecular weight of 209.25 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea is sourced from PubChem (CID 51264614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).