2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one

C19H22N4O2 — CID 157405231

IUPAC2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one
SMILESCCn1c(CC2=NC(N3CCOCC3)=CC(=O)C2)nc2ccccc21
InChIInChI=1S/C19H22N4O2/c1-2-23-17-6-4-3-5-16(17)21-19(23)12-14-11-15(24)13-18(20-14)22-7-9-25-10-8-22/h3-6,13H,2,7-12H2,1H3
InChIKeyBNQIMPMUPIYYJG-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.19
Rot. Bonds4

About 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one

2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one (PubChem CID 157405231) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one.

Molecular Properties

Compound Name2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one
PubChem CID157405231
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one
SMILESCCn1c(CC2=NC(N3CCOCC3)=CC(=O)C2)nc2ccccc21
InChIInChI=1S/C19H22N4O2/c1-2-23-17-6-4-3-5-16(17)21-19(23)12-14-11-15(24)13-18(20-14)22-7-9-25-10-8-22/h3-6,13H,2,7-12H2,1H3
InChIKeyBNQIMPMUPIYYJG-UHFFFAOYSA-N
XLogP2.19
TPSA59.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(1-cyclohexylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 158267441
N-ethyl-3-(3-morpholin-4-yl-2-oxoquinoxalin-1-yl)propanamide
CID 91951590
[4-(1-ethylbenzimidazol-2-yl)piperazin-1-yl]-morpholin-4-ylmethanone
CID 3545151
3-[(1-ethylbenzimidazol-2-yl)methyl]furan-2-carbaldehyde
CID 106886542
1-methyl-3-morpholin-4-ylquinoxalin-2-one
CID 146169023
4-[(1-ethylbenzimidazol-2-yl)methyl]cyclohex-3-en-1-one
CID 83262167
4-[(1-ethylbenzimidazol-2-yl)methyl]phenol
CID 43142753
2-[3-(2,3-difluorophenyl)-2-oxopropyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 160582302
2-(1-ethylbenzimidazol-2-yl)-1-(oxan-4-yl)ethanol
CID 79753249
1-morpholin-4-yl-2-(2-propylbenzimidazol-1-yl)ethanone
CID 115569311
1-ethyl-N-(2-morpholin-4-ylethyl)benzimidazol-2-amine;dihydrochloride
CID 44888954
methyl 2-(2-morpholin-4-ylbenzimidazol-1-yl)acetate
CID 66492644

Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one?
The IUPAC name of 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one (CID 157405231) is 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one.
What is the SMILES notation for 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one?
The canonical SMILES for 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one is CCn1c(CC2=NC(N3CCOCC3)=CC(=O)C2)nc2ccccc21.
What is the InChIKey of 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one?
The InChIKey is BNQIMPMUPIYYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-2-23-17-6-4-3-5-16(17)21-19(23)12-14-11-15(24)13-18(20-14)22-7-9-25-10-8-22/h3-6,13H,2,7-12H2,1H3.
What are the key properties of 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one?
2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one has a molecular weight of 338.41 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylbenzimidazol-2-yl)methyl]-6-morpholin-4-yl-3H-pyridin-4-one is sourced from PubChem (CID 157405231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).