1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one

C15H14ClN5O — CID 66576563

IUPAC1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one
SMILESO=C1N(c2cc(Cl)ncn2)CCN1c1cnccc1C1CC1
InChIInChI=1S/C15H14ClN5O/c16-13-7-14(19-9-18-13)21-6-5-20(15(21)22)12-8-17-4-3-11(12)10-1-2-10/h3-4,7-10H,1-2,5-6H2
InChIKeyUYVBLLNHMFATNQ-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.85
Rot. Bonds3

About 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one

1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one (PubChem CID 66576563) has the molecular formula C15H14ClN5O and a molecular weight of 315.76 g/mol. Its IUPAC name is 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one
PubChem CID66576563
Molecular FormulaC15H14ClN5O
Molecular Weight315.76 g/mol
Exact Mass315.09
IUPAC Name1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one
SMILESO=C1N(c2cc(Cl)ncn2)CCN1c1cnccc1C1CC1
InChIInChI=1S/C15H14ClN5O/c16-13-7-14(19-9-18-13)21-6-5-20(15(21)22)12-8-17-4-3-11(12)10-1-2-10/h3-4,7-10H,1-2,5-6H2
InChIKeyUYVBLLNHMFATNQ-UHFFFAOYSA-N
XLogP2.85
TPSA62.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one?
The IUPAC name of 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one (CID 66576563) is 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one.
What is the SMILES notation for 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one?
The canonical SMILES for 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one is O=C1N(c2cc(Cl)ncn2)CCN1c1cnccc1C1CC1.
What is the InChIKey of 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one?
The InChIKey is UYVBLLNHMFATNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN5O/c16-13-7-14(19-9-18-13)21-6-5-20(15(21)22)12-8-17-4-3-11(12)10-1-2-10/h3-4,7-10H,1-2,5-6H2.
What are the key properties of 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one?
1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one has a molecular weight of 315.76 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloropyrimidin-4-yl)-3-(4-cyclopropyl-3-pyridinyl)imidazolidin-2-one is sourced from PubChem (CID 66576563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).