1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea

C15H22N4O2 — CID 38203859

IUPAC1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)NC1CCCC1
InChIInChI=1S/C15H22N4O2/c20-15(17-12-3-1-2-4-12)18-13-5-6-14(16-11-13)19-7-9-21-10-8-19/h5-6,11-12H,1-4,7-10H2,(H2,17,18,20)
InChIKeyUFDVBFJLKNOYEC-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.98
Rot. Bonds3

About 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea

1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea (PubChem CID 38203859) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea.

Molecular Properties

Compound Name1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
PubChem CID38203859
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)NC1CCCC1
InChIInChI=1S/C15H22N4O2/c20-15(17-12-3-1-2-4-12)18-13-5-6-14(16-11-13)19-7-9-21-10-8-19/h5-6,11-12H,1-4,7-10H2,(H2,17,18,20)
InChIKeyUFDVBFJLKNOYEC-UHFFFAOYSA-N
XLogP1.98
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
The IUPAC name of 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea (CID 38203859) is 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea.
What is the SMILES notation for 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
The canonical SMILES for 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea is O=C(Nc1ccc(N2CCOCC2)nc1)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
The InChIKey is UFDVBFJLKNOYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-15(17-12-3-1-2-4-12)18-13-5-6-14(16-11-13)19-7-9-21-10-8-19/h5-6,11-12H,1-4,7-10H2,(H2,17,18,20).
What are the key properties of 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea has a molecular weight of 290.37 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(6-morpholin-4-yl-3-pyridinyl)urea is sourced from PubChem (CID 38203859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).