1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea

C18H20N4O3 — CID 95309227

IUPAC1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea
SMILESCc1cn2cc(NC(=O)NC[C@@H](O)COc3ccccc3)ccc2n1
InChIInChI=1S/C18H20N4O3/c1-13-10-22-11-14(7-8-17(22)20-13)21-18(24)19-9-15(23)12-25-16-5-3-2-4-6-16/h2-8,10-11,15,23H,9,12H2,1H3,(H2,19,21,24)/t15-/m1/s1
InChIKeyVZFMNTXHHAAVFK-OAHLLOKOSA-N
MW340.38 g/mol
LogP2.20
Rot. Bonds6

About 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea

1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea (PubChem CID 95309227) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea.

Molecular Properties

Compound Name1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea
PubChem CID95309227
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC Name1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea
SMILESCc1cn2cc(NC(=O)NC[C@@H](O)COc3ccccc3)ccc2n1
InChIInChI=1S/C18H20N4O3/c1-13-10-22-11-14(7-8-17(22)20-13)21-18(24)19-9-15(23)12-25-16-5-3-2-4-6-16/h2-8,10-11,15,23H,9,12H2,1H3,(H2,19,21,24)/t15-/m1/s1
InChIKeyVZFMNTXHHAAVFK-OAHLLOKOSA-N
XLogP2.20
TPSA87.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea with MolForge

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Related Compounds

1-(4-fluorophenyl)-3-[2-hydroxy-3-(3-methylphenoxy)propyl]urea
CID 110904652
1-[(2R)-2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 6975841
1-[2-hydroxy-3-(2-methylpropoxy)propyl]-3-(4-phenoxyphenyl)urea
CID 87007221
1-benzyl-3-[2-hydroxy-3-(3-methylphenoxy)propyl]urea
CID 110904579
3-(2-methoxyphenyl)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)propanamide
CID 110734835
tert-butyl N-(2-hydroxy-3-phenoxypropyl)carbamate
CID 14249476
2-(2-fluorophenyl)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)acetamide
CID 110734846
1-(2,3-dimethylphenyl)-3-[2-hydroxy-3-(3-methylphenoxy)propyl]urea
CID 110907958
1-[4-[2-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]ethyl]phenyl]-3-phenylurea;hydrochloride
CID 52949022
1-[1-(1H-indol-5-yl)-2-methoxyethyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea
CID 166364308
(2R)-1-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]-3-phenoxypropan-2-ol
CID 7037801
benzyl N-[(2R)-2-hydroxy-3-phenoxypropyl]carbamate
CID 102235547

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea?
The IUPAC name of 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea (CID 95309227) is 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea.
What is the SMILES notation for 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea?
The canonical SMILES for 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea is Cc1cn2cc(NC(=O)NC[C@@H](O)COc3ccccc3)ccc2n1.
What is the InChIKey of 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea?
The InChIKey is VZFMNTXHHAAVFK-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H20N4O3/c1-13-10-22-11-14(7-8-17(22)20-13)21-18(24)19-9-15(23)12-25-16-5-3-2-4-6-16/h2-8,10-11,15,23H,9,12H2,1H3,(H2,19,21,24)/t15-/m1/s1.
What are the key properties of 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea?
1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea has a molecular weight of 340.38 g/mol, XLogP of 2.20, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-hydroxy-3-phenoxypropyl]-3-(2-methylimidazo[1,2-a]pyridin-6-yl)urea is sourced from PubChem (CID 95309227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).