1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea

C13H15N5O — CID 141037409

IUPAC1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea
SMILESO=C(Nc1ccc2cncnc2n1)NC1CCCC1
InChIInChI=1S/C13H15N5O/c19-13(16-10-3-1-2-4-10)18-11-6-5-9-7-14-8-15-12(9)17-11/h5-8,10H,1-4H2,(H2,14,15,16,17,18,19)
InChIKeySBJHBUBYSWDAKG-UHFFFAOYSA-N
MW257.30 g/mol
LogP2.09
Rot. Bonds2

About 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea

1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea (PubChem CID 141037409) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea.

Molecular Properties

Compound Name1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea
PubChem CID141037409
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea
SMILESO=C(Nc1ccc2cncnc2n1)NC1CCCC1
InChIInChI=1S/C13H15N5O/c19-13(16-10-3-1-2-4-10)18-11-6-5-9-7-14-8-15-12(9)17-11/h5-8,10H,1-4H2,(H2,14,15,16,17,18,19)
InChIKeySBJHBUBYSWDAKG-UHFFFAOYSA-N
XLogP2.09
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-3-[6-(cyclohexylcarbamoylamino)-2-pyridinyl]urea
CID 4149033
1-(5-cyano-2-pyridinyl)-3-cyclohexylurea
CID 55063233
1-cyclopentyl-3-(2-pyridin-4-ylpyrimidin-4-yl)urea
CID 21404741
5-[6-(cyclopentylcarbamoylamino)pyrido[2,3-b]pyrazin-3-yl]thiophene-2-carboxylic acid
CID 70815017
1-cyclopentyl-3-[2-(N-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]urea
CID 90949063
1-cyclopentyl-3-[3-(5-propan-2-ylfuran-2-yl)pyrido[2,3-b]pyrazin-6-yl]urea
CID 70815080
1-cyclohexyl-3-[6-(cyclopropylamino)-3-pyridinyl]urea
CID 113009249
1-[6-(cycloheptylamino)-3-pyridinyl]-3-cyclopropylurea
CID 113014951
1-cyclopropyl-3-pyrimidin-5-ylurea
CID 104859363
6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid
CID 62697960
1-cycloheptyl-3-(1,2-oxazol-3-yl)urea
CID 108811981
1-[6-(azepan-1-yl)pyridazin-3-yl]-3-cyclohexylurea
CID 113045369

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea?
The IUPAC name of 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea (CID 141037409) is 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea.
What is the SMILES notation for 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea?
The canonical SMILES for 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea is O=C(Nc1ccc2cncnc2n1)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea?
The InChIKey is SBJHBUBYSWDAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c19-13(16-10-3-1-2-4-10)18-11-6-5-9-7-14-8-15-12(9)17-11/h5-8,10H,1-4H2,(H2,14,15,16,17,18,19).
What are the key properties of 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea?
1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea has a molecular weight of 257.30 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-pyrido[2,3-d]pyrimidin-7-ylurea is sourced from PubChem (CID 141037409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).