1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea

C15H23N5O2 — CID 113025672

IUPAC1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea
SMILESO=C(Nc1ccc(NCCN2CCOCC2)cn1)NC1CC1
InChIInChI=1S/C15H23N5O2/c21-15(18-12-1-2-12)19-14-4-3-13(11-17-14)16-5-6-20-7-9-22-10-8-20/h3-4,11-12,16H,1-2,5-10H2,(H2,17,18,19,21)
InChIKeyJCZRNTIRTIELIY-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.11
Rot. Bonds6

About 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea

1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea (PubChem CID 113025672) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea.

Molecular Properties

Compound Name1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea
PubChem CID113025672
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea
SMILESO=C(Nc1ccc(NCCN2CCOCC2)cn1)NC1CC1
InChIInChI=1S/C15H23N5O2/c21-15(18-12-1-2-12)19-14-4-3-13(11-17-14)16-5-6-20-7-9-22-10-8-20/h3-4,11-12,16H,1-2,5-10H2,(H2,17,18,19,21)
InChIKeyJCZRNTIRTIELIY-UHFFFAOYSA-N
XLogP1.11
TPSA78.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea?
The IUPAC name of 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea (CID 113025672) is 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea.
What is the SMILES notation for 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea?
The canonical SMILES for 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea is O=C(Nc1ccc(NCCN2CCOCC2)cn1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea?
The InChIKey is JCZRNTIRTIELIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c21-15(18-12-1-2-12)19-14-4-3-13(11-17-14)16-5-6-20-7-9-22-10-8-20/h3-4,11-12,16H,1-2,5-10H2,(H2,17,18,19,21).
What are the key properties of 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea?
1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea has a molecular weight of 305.38 g/mol, XLogP of 1.11, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]urea is sourced from PubChem (CID 113025672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).