1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea

C19H23FN4O2 — CID 155811046

IUPAC1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea
SMILESCN1CCC(NC(=O)Nc2ncccc2OCc2cccc(F)c2)CC1
InChIInChI=1S/C19H23FN4O2/c1-24-10-7-16(8-11-24)22-19(25)23-18-17(6-3-9-21-18)26-13-14-4-2-5-15(20)12-14/h2-6,9,12,16H,7-8,10-11,13H2,1H3,(H2,21,22,23,25)
InChIKeyBDTNGYWOBBBLTI-UHFFFAOYSA-N
MW358.42 g/mol
LogP3.02
Rot. Bonds5

About 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea

1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea (PubChem CID 155811046) has the molecular formula C19H23FN4O2 and a molecular weight of 358.42 g/mol. Its IUPAC name is 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea.

Molecular Properties

Compound Name1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea
PubChem CID155811046
Molecular FormulaC19H23FN4O2
Molecular Weight358.42 g/mol
Exact Mass358.18
IUPAC Name1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea
SMILESCN1CCC(NC(=O)Nc2ncccc2OCc2cccc(F)c2)CC1
InChIInChI=1S/C19H23FN4O2/c1-24-10-7-16(8-11-24)22-19(25)23-18-17(6-3-9-21-18)26-13-14-4-2-5-15(20)12-14/h2-6,9,12,16H,7-8,10-11,13H2,1H3,(H2,21,22,23,25)
InChIKeyBDTNGYWOBBBLTI-UHFFFAOYSA-N
XLogP3.02
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Amino-3-benzyloxypyridine
CID 90334
Tak-915
CID 72190879
Rbi 257
CID 5041
U 101958
CID 5615
3-[3-(Benzyloxy)pyridin-2-yl]-1-phenylurea
CID 3663276
4-(5,6-Dimethyl-2-pyridin-2-yl-pyridin-3-yl)oxy-N-(4-fluorophenyl)pyridin-2-amine
CID 44521026
6-({[5-({[2-(3-Fluorophenyl)ethyl]amino}methyl)pyridin-3-Yl]oxy}methyl)-4-Methylpyridin-2-Amine
CID 71627414
N-[[4-(1-propan-2-ylpiperidin-4-yl)oxyphenyl]methyl]pyridin-2-amine
CID 9880373
8-[[(5-Cyclobutyloxy-2-pyridinyl)amino]methyl]-3-pyridin-2-yl-1-oxa-3-azaspiro[4.5]decan-2-one
CID 44159353
4-N-[2-(4-fluorophenoxy)ethyl]-2-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 44393134
US10155760, Example 12
CID 118420154
US10155760, Example 27
CID 118420285

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea?
The IUPAC name of 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea (CID 155811046) is 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea.
What is the SMILES notation for 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea?
The canonical SMILES for 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea is CN1CCC(NC(=O)Nc2ncccc2OCc2cccc(F)c2)CC1.
What is the InChIKey of 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea?
The InChIKey is BDTNGYWOBBBLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN4O2/c1-24-10-7-16(8-11-24)22-19(25)23-18-17(6-3-9-21-18)26-13-14-4-2-5-15(20)12-14/h2-6,9,12,16H,7-8,10-11,13H2,1H3,(H2,21,22,23,25).
What are the key properties of 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea?
1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea has a molecular weight of 358.42 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(3-fluorophenyl)methoxy]-2-pyridinyl]-3-(1-methylpiperidin-4-yl)urea is sourced from PubChem (CID 155811046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).