3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide

C19H23N5O — CID 91760615

IUPAC3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide
SMILESCc1ccc2[nH]c(CCC(=O)NC(C)Cc3cnccn3)nc2c1C
InChIInChI=1S/C19H23N5O/c1-12-4-5-16-19(14(12)3)24-17(23-16)6-7-18(25)22-13(2)10-15-11-20-8-9-21-15/h4-5,8-9,11,13H,6-7,10H2,1-3H3,(H,22,25)(H,23,24)
InChIKeyVMPFDSFMYROYPV-UHFFFAOYSA-N
MW337.43 g/mol
LogP2.65
Rot. Bonds6

About 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide

3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide (PubChem CID 91760615) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide.

Molecular Properties

Compound Name3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide
PubChem CID91760615
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide
SMILESCc1ccc2[nH]c(CCC(=O)NC(C)Cc3cnccn3)nc2c1C
InChIInChI=1S/C19H23N5O/c1-12-4-5-16-19(14(12)3)24-17(23-16)6-7-18(25)22-13(2)10-15-11-20-8-9-21-15/h4-5,8-9,11,13H,6-7,10H2,1-3H3,(H,22,25)(H,23,24)
InChIKeyVMPFDSFMYROYPV-UHFFFAOYSA-N
XLogP2.65
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-[1-(1,2,4-triazol-1-yl)propan-2-yl]propanamide
CID 135101692
3-(2-methoxyphenyl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide
CID 91775688
3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-[3-(2-oxo-1-pyridinyl)propyl]propanamide
CID 90654010
N-[2-(4,5-dimethyl-1H-benzimidazol-2-yl)ethyl]methanesulfonamide
CID 131934944
N-[2-(4,5-dimethyl-1H-benzimidazol-2-yl)ethyl]propane-2-sulfonamide
CID 131918098
N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-3-pyrazin-2-ylpropanamide
CID 118782048
(2R)-N-[3-(4,5-dimethyl-1H-benzimidazol-2-yl)propyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 97269122
N-(1-amino-2,3-dimethylbutan-2-yl)-3-(4-methyl-1H-benzimidazol-2-yl)propanamide
CID 119607252
2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide
CID 91782726
4,5-dimethyl-2-octyl-1H-benzimidazole
CID 54123054
5-methyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrazine-2-carboxamide
CID 91779730
N-[3-(4,5-dimethyl-1H-benzimidazol-2-yl)propyl]-4-pyrazol-1-ylbutanamide
CID 91841705

Frequently Asked Questions

What is the IUPAC name of 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide?
The IUPAC name of 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide (CID 91760615) is 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide.
What is the SMILES notation for 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide?
The canonical SMILES for 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide is Cc1ccc2[nH]c(CCC(=O)NC(C)Cc3cnccn3)nc2c1C.
What is the InChIKey of 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide?
The InChIKey is VMPFDSFMYROYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-12-4-5-16-19(14(12)3)24-17(23-16)6-7-18(25)22-13(2)10-15-11-20-8-9-21-15/h4-5,8-9,11,13H,6-7,10H2,1-3H3,(H,22,25)(H,23,24).
What are the key properties of 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide?
3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide has a molecular weight of 337.43 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide is sourced from PubChem (CID 91760615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).