N-(1-propylbenzimidazol-2-yl)nonanamide

C19H29N3O — CID 162645010

IUPACN-(1-propylbenzimidazol-2-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1nc2ccccc2n1CCC
InChIInChI=1S/C19H29N3O/c1-3-5-6-7-8-9-14-18(23)21-19-20-16-12-10-11-13-17(16)22(19)15-4-2/h10-13H,3-9,14-15H2,1-2H3,(H,20,21,23)
InChIKeyHQSDEWIXGNYQLN-UHFFFAOYSA-N
MW315.46 g/mol
LogP5.14
Rot. Bonds10

About N-(1-propylbenzimidazol-2-yl)nonanamide

N-(1-propylbenzimidazol-2-yl)nonanamide (PubChem CID 162645010) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is N-(1-propylbenzimidazol-2-yl)nonanamide.

Molecular Properties

Compound NameN-(1-propylbenzimidazol-2-yl)nonanamide
PubChem CID162645010
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC NameN-(1-propylbenzimidazol-2-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1nc2ccccc2n1CCC
InChIInChI=1S/C19H29N3O/c1-3-5-6-7-8-9-14-18(23)21-19-20-16-12-10-11-13-17(16)22(19)15-4-2/h10-13H,3-9,14-15H2,1-2H3,(H,20,21,23)
InChIKeyHQSDEWIXGNYQLN-UHFFFAOYSA-N
XLogP5.14
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.46
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-N-(1-propylbenzimidazol-2-yl)butanamide
CID 35280168
7-amino-N-(1-ethylbenzimidazol-2-yl)heptanamide
CID 119678504
N-(1-octylbenzimidazol-2-yl)benzamide
CID 21449929
3-(4-methylphenoxy)-N-(1-propylbenzimidazol-2-yl)propanamide
CID 8914517
2-[3-oxo-3-[(1-propylbenzimidazol-2-yl)amino]propyl]pyrazole-3-carboxylic acid
CID 19492211
4-(5-methylthiophen-2-yl)-4-oxo-N-(1-propylbenzimidazol-2-yl)butanamide
CID 30178636
(2E,4E)-N-(1-propylbenzimidazol-2-yl)hexa-2,4-dienamide
CID 38011370
2-(2-oxoquinoxalin-1-yl)-N-(1-propylbenzimidazol-2-yl)acetamide
CID 16585553
6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(1-propylbenzimidazol-2-yl)hexanamide
CID 24601101
(E)-N-(1-propylbenzimidazol-2-yl)-3-thiophen-2-ylprop-2-enamide
CID 8914471
N-(1-propylbenzimidazol-2-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 27134350
(1-pentylbenzimidazol-2-yl)hydrazine
CID 4136867

Frequently Asked Questions

What is the IUPAC name of N-(1-propylbenzimidazol-2-yl)nonanamide?
The IUPAC name of N-(1-propylbenzimidazol-2-yl)nonanamide (CID 162645010) is N-(1-propylbenzimidazol-2-yl)nonanamide.
What is the SMILES notation for N-(1-propylbenzimidazol-2-yl)nonanamide?
The canonical SMILES for N-(1-propylbenzimidazol-2-yl)nonanamide is CCCCCCCCC(=O)Nc1nc2ccccc2n1CCC.
What is the InChIKey of N-(1-propylbenzimidazol-2-yl)nonanamide?
The InChIKey is HQSDEWIXGNYQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c1-3-5-6-7-8-9-14-18(23)21-19-20-16-12-10-11-13-17(16)22(19)15-4-2/h10-13H,3-9,14-15H2,1-2H3,(H,20,21,23).
What are the key properties of N-(1-propylbenzimidazol-2-yl)nonanamide?
N-(1-propylbenzimidazol-2-yl)nonanamide has a molecular weight of 315.46 g/mol, XLogP of 5.14, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propylbenzimidazol-2-yl)nonanamide is sourced from PubChem (CID 162645010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).