1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea

C19H17ClN4O3 — CID 139489185

IUPAC1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea
SMILESCOc1ccc(NC(=O)Nc2cccc(Oc3cc(Cl)cnc3N)c2)cc1
InChIInChI=1S/C19H17ClN4O3/c1-26-15-7-5-13(6-8-15)23-19(25)24-14-3-2-4-16(10-14)27-17-9-12(20)11-22-18(17)21/h2-11H,1H3,(H2,21,22)(H2,23,24,25)
InChIKeySPOSVCNVNPAGOY-UHFFFAOYSA-N
MW384.82 g/mol
LogP4.76
Rot. Bonds5

About 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea

1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea (PubChem CID 139489185) has the molecular formula C19H17ClN4O3 and a molecular weight of 384.82 g/mol. Its IUPAC name is 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea.

Molecular Properties

Compound Name1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea
PubChem CID139489185
Molecular FormulaC19H17ClN4O3
Molecular Weight384.82 g/mol
Exact Mass384.10
IUPAC Name1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea
SMILESCOc1ccc(NC(=O)Nc2cccc(Oc3cc(Cl)cnc3N)c2)cc1
InChIInChI=1S/C19H17ClN4O3/c1-26-15-7-5-13(6-8-15)23-19(25)24-14-3-2-4-16(10-14)27-17-9-12(20)11-22-18(17)21/h2-11H,1H3,(H2,21,22)(H2,23,24,25)
InChIKeySPOSVCNVNPAGOY-UHFFFAOYSA-N
XLogP4.76
TPSA98.50 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.82
LogP ≤ 54.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 872322
1-(3-chlorophenyl)-3-(4-methoxyphenyl)urea
CID 727874
1-(5-chloro-3-pyridinyl)-3-(3-methoxyphenyl)urea
CID 35290961
1-[2-[4-(2-amino-5-chloro-3-pyridinyl)phenoxy]pyrimidin-5-yl]-3-(3-chloro-5-methoxyphenyl)urea
CID 118596579
N-[3-[(1R)-1-[(2-amino-5-chloro-3-pyridinyl)oxy]ethyl]phenyl]-3-methoxybenzamide
CID 139489368
1-[3-[(2-amino-5-pyridin-3-yl-3-pyridinyl)oxy]phenyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea
CID 139489278
1-(3,4-diaminophenyl)-3-(3-methoxyphenyl)urea
CID 155694037
1-(4-amino-3-chlorophenyl)-3-(4-methoxyphenyl)urea
CID 82861747
3-[(4-methoxyphenyl)carbamoylamino]benzamide
CID 572736
1-(2-chloro-4-pyridinyl)-3-(3-methoxyphenyl)urea
CID 86001834
1-(4-chlorophenyl)-3-(3,5-dimethoxyphenyl)urea
CID 5080990
1-(3-methoxy-4-phenoxyphenyl)-3-(3-methoxyphenyl)urea
CID 139434076

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea?
The IUPAC name of 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea (CID 139489185) is 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea.
What is the SMILES notation for 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea?
The canonical SMILES for 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea is COc1ccc(NC(=O)Nc2cccc(Oc3cc(Cl)cnc3N)c2)cc1.
What is the InChIKey of 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea?
The InChIKey is SPOSVCNVNPAGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O3/c1-26-15-7-5-13(6-8-15)23-19(25)24-14-3-2-4-16(10-14)27-17-9-12(20)11-22-18(17)21/h2-11H,1H3,(H2,21,22)(H2,23,24,25).
What are the key properties of 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea?
1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea has a molecular weight of 384.82 g/mol, XLogP of 4.76, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(2-amino-5-chloro-3-pyridinyl)oxy]phenyl]-3-(4-methoxyphenyl)urea is sourced from PubChem (CID 139489185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).