3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea

C24H24N4O — CID 71802045

IUPAC3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea
SMILESCCN(Cc1cnc2ccccn12)C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24N4O/c1-2-27(18-21-17-25-22-15-9-10-16-28(21)22)24(29)26-23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-17,23H,2,18H2,1H3,(H,26,29)
InChIKeyHSKZAQWTDODBHT-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.66
Rot. Bonds6

About 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea

3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea (PubChem CID 71802045) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea.

Molecular Properties

Compound Name3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea
PubChem CID71802045
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea
SMILESCCN(Cc1cnc2ccccn12)C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24N4O/c1-2-27(18-21-17-25-22-15-9-10-16-28(21)22)24(29)26-23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-17,23H,2,18H2,1H3,(H,26,29)
InChIKeyHSKZAQWTDODBHT-UHFFFAOYSA-N
XLogP4.66
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-diethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)butanamide
CID 90570483
1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-prop-2-enylurea
CID 90570703
3-(2,6-difluorophenyl)-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea
CID 90570690
1-ethyl-3-(4-fluorophenyl)-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea
CID 90570681
1-ethyl-3-(2-fluorophenyl)-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea
CID 90570706
N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-phenoxypropanamide
CID 90570565
1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-[(4-methoxyphenyl)methyl]urea
CID 71802043
1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-(3-methoxyphenyl)urea
CID 90570682
N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-9H-xanthene-9-carboxamide
CID 71802028
2-imidazo[1,2-a]pyridin-3-ylacetic acid;dihydrochloride
CID 67654872
N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-4-(trifluoromethoxy)benzamide
CID 90570672
(E)-3-(1,3-benzodioxol-5-yl)-N-ethyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)prop-2-enamide
CID 71802026

Frequently Asked Questions

What is the IUPAC name of 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea?
The IUPAC name of 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea (CID 71802045) is 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea.
What is the SMILES notation for 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea?
The canonical SMILES for 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea is CCN(Cc1cnc2ccccn12)C(=O)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea?
The InChIKey is HSKZAQWTDODBHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-2-27(18-21-17-25-22-15-9-10-16-28(21)22)24(29)26-23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-17,23H,2,18H2,1H3,(H,26,29).
What are the key properties of 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea?
3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea has a molecular weight of 384.48 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzhydryl-1-ethyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)urea is sourced from PubChem (CID 71802045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).