1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea

C15H14FN3O — CID 110469651

IUPAC1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea
SMILESO=C(Nc1ccncc1)NC1(c2ccccc2F)CC1
InChIInChI=1S/C15H14FN3O/c16-13-4-2-1-3-12(13)15(7-8-15)19-14(20)18-11-5-9-17-10-6-11/h1-6,9-10H,7-8H2,(H2,17,18,19,20)
InChIKeyGSZUFIADZUKQPR-UHFFFAOYSA-N
MW271.30 g/mol
LogP3.03
Rot. Bonds3

About 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea

1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea (PubChem CID 110469651) has the molecular formula C15H14FN3O and a molecular weight of 271.30 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea
PubChem CID110469651
Molecular FormulaC15H14FN3O
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC Name1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea
SMILESO=C(Nc1ccncc1)NC1(c2ccccc2F)CC1
InChIInChI=1S/C15H14FN3O/c16-13-4-2-1-3-12(13)15(7-8-15)19-14(20)18-11-5-9-17-10-6-11/h1-6,9-10H,7-8H2,(H2,17,18,19,20)
InChIKeyGSZUFIADZUKQPR-UHFFFAOYSA-N
XLogP3.03
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(2-fluorophenyl)cyclopropyl]-3-pyrimidin-4-ylurea
CID 110490668
1-cyclopropyl-3-[1-(2-fluorophenyl)cyclopropyl]urea
CID 110469627
N-[1-(2-fluorophenyl)cyclopropyl]propanamide
CID 110477459
1-(3-aminopropyl)-3-[1-(2-fluorophenyl)cyclopropyl]urea
CID 110490666
N-[1-(2-fluorophenyl)cyclopropyl]-2-pyridin-3-ylacetamide
CID 110468072
1-tert-butyl-3-[1-(2-fluorophenyl)cyclopentyl]urea
CID 110469941
4-[[1-(2-fluorophenyl)cyclopropyl]amino]-4-oxobutanoic acid
CID 110465781
1-[1-(2-fluorophenyl)cyclopropyl]-3-(1H-pyrrol-2-ylmethyl)urea
CID 110469652
N-[1-(2-fluorophenyl)cyclopropyl]cyclohexanecarboxamide
CID 110482201
N-[1-(2-fluorophenyl)cyclopropyl]-4-hydroxybutanamide
CID 110480254
5-[[1-(2-fluorophenyl)cyclopropyl]carbamoyl]pyridine-2-carboxylic acid
CID 119136012
N-[1-(2-fluorophenyl)cyclopropyl]-6-methylpyridine-2-carboxamide
CID 110462508

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea?
The IUPAC name of 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea (CID 110469651) is 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea.
What is the SMILES notation for 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea?
The canonical SMILES for 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea is O=C(Nc1ccncc1)NC1(c2ccccc2F)CC1.
What is the InChIKey of 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea?
The InChIKey is GSZUFIADZUKQPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O/c16-13-4-2-1-3-12(13)15(7-8-15)19-14(20)18-11-5-9-17-10-6-11/h1-6,9-10H,7-8H2,(H2,17,18,19,20).
What are the key properties of 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea?
1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea has a molecular weight of 271.30 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)cyclopropyl]-3-pyridin-4-ylurea is sourced from PubChem (CID 110469651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).