3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide

C19H21N5O2 — CID 60576832

IUPAC3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide
SMILESO=C(CCn1cnc2ccccc21)Nc1cccnc1N1CCOCC1
InChIInChI=1S/C19H21N5O2/c25-18(7-9-24-14-21-15-4-1-2-6-17(15)24)22-16-5-3-8-20-19(16)23-10-12-26-13-11-23/h1-6,8,14H,7,9-13H2,(H,22,25)
InChIKeySGXBTLMWIVQDAO-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.30
Rot. Bonds5

About 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide

3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide (PubChem CID 60576832) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide
PubChem CID60576832
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide
SMILESO=C(CCn1cnc2ccccc21)Nc1cccnc1N1CCOCC1
InChIInChI=1S/C19H21N5O2/c25-18(7-9-24-14-21-15-4-1-2-6-17(15)24)22-16-5-3-8-20-19(16)23-10-12-26-13-11-23/h1-6,8,14H,7,9-13H2,(H,22,25)
InChIKeySGXBTLMWIVQDAO-UHFFFAOYSA-N
XLogP2.30
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-morpholin-4-yl-3-pyridinyl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 60576683
3-(benzimidazol-1-yl)-N-(2-ethoxy-3-pyridinyl)propanamide
CID 34879800
4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
CID 119845870
3-(4-methylphenyl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide
CID 60576563
3-(benzimidazol-1-yl)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 60554892
3-(benzimidazol-1-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]propanamide
CID 103849264
3-(benzimidazol-1-yl)-N-(2,5-dimethylphenyl)propanamide
CID 25349690
N-(4-aminophenyl)-3-(benzimidazol-1-yl)propanamide
CID 16781831
N-(5-amino-2-fluorophenyl)-3-(benzimidazol-1-yl)propanamide
CID 16785328
2-(1,3-benzodioxol-5-yl)-N-(2-morpholin-4-yl-3-pyridinyl)acetamide
CID 75405128
3-(benzimidazol-1-yl)-N-(pyridin-2-ylmethylideneamino)propanamide
CID 5144752
N-(2-morpholin-4-yl-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
CID 119845865

Frequently Asked Questions

What is the IUPAC name of 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide?
The IUPAC name of 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide (CID 60576832) is 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide?
The canonical SMILES for 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide is O=C(CCn1cnc2ccccc21)Nc1cccnc1N1CCOCC1.
What is the InChIKey of 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide?
The InChIKey is SGXBTLMWIVQDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c25-18(7-9-24-14-21-15-4-1-2-6-17(15)24)22-16-5-3-8-20-19(16)23-10-12-26-13-11-23/h1-6,8,14H,7,9-13H2,(H,22,25).
What are the key properties of 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide?
3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide has a molecular weight of 351.41 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 60576832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).