N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide

C15H22N4O — CID 745084

IUPACN-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide
SMILESCCC(=O)Nc1nc2ccccc2n1CCCN(C)C
InChIInChI=1S/C15H22N4O/c1-4-14(20)17-15-16-12-8-5-6-9-13(12)19(15)11-7-10-18(2)3/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,16,17,20)
InChIKeyZPZUVAMKLZFWMJ-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.34
Rot. Bonds6

About N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide

N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide (PubChem CID 745084) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide.

Molecular Properties

Compound NameN-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide
PubChem CID745084
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide
SMILESCCC(=O)Nc1nc2ccccc2n1CCCN(C)C
InChIInChI=1S/C15H22N4O/c1-4-14(20)17-15-16-12-8-5-6-9-13(12)19(15)11-7-10-18(2)3/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,16,17,20)
InChIKeyZPZUVAMKLZFWMJ-UHFFFAOYSA-N
XLogP2.34
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[1-[2-(diethylamino)ethyl]benzimidazol-2-yl]acetamide
CID 6611163
N-(1-propylbenzimidazol-2-yl)nonanamide
CID 162645010
N-[[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]methyl]acetamide
CID 52904872
N-(1-octylbenzimidazol-2-yl)benzamide
CID 21449929
4-methoxy-N-(1-propylbenzimidazol-2-yl)butanamide
CID 35280168
2-(2-oxoquinoxalin-1-yl)-N-(1-propylbenzimidazol-2-yl)acetamide
CID 16585553
2-amino-N-(1-ethylbenzimidazol-2-yl)acetamide;hydrochloride
CID 119265457
2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide
CID 46970461
7-amino-N-(1-ethylbenzimidazol-2-yl)heptanamide
CID 119678504
3-(4-methylphenoxy)-N-(1-propylbenzimidazol-2-yl)propanamide
CID 8914517
1-methyl-6-oxo-N-(1-propylbenzimidazol-2-yl)pyridazine-3-carboxamide
CID 4879642
(1-pentylbenzimidazol-2-yl)hydrazine
CID 4136867

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide?
The IUPAC name of N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide (CID 745084) is N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide.
What is the SMILES notation for N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide?
The canonical SMILES for N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide is CCC(=O)Nc1nc2ccccc2n1CCCN(C)C.
What is the InChIKey of N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide?
The InChIKey is ZPZUVAMKLZFWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-4-14(20)17-15-16-12-8-5-6-9-13(12)19(15)11-7-10-18(2)3/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,16,17,20).
What are the key properties of N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide?
N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide has a molecular weight of 274.37 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]propanamide is sourced from PubChem (CID 745084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).