N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide

C19H23N5O — CID 86285007

IUPACN-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
SMILESCCn1c(CNC(=O)CN(C)Cc2ccncc2)nc2ccccc21
InChIInChI=1S/C19H23N5O/c1-3-24-17-7-5-4-6-16(17)22-18(24)12-21-19(25)14-23(2)13-15-8-10-20-11-9-15/h4-11H,3,12-14H2,1-2H3,(H,21,25)
InChIKeyZTIMUHZDJWKDBZ-UHFFFAOYSA-N
MW337.43 g/mol
LogP2.20
Rot. Bonds7

About N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide

N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide (PubChem CID 86285007) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
PubChem CID86285007
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC NameN-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
SMILESCCn1c(CNC(=O)CN(C)Cc2ccncc2)nc2ccccc21
InChIInChI=1S/C19H23N5O/c1-3-24-17-7-5-4-6-16(17)22-18(24)12-21-19(25)14-23(2)13-15-8-10-20-11-9-15/h4-11H,3,12-14H2,1-2H3,(H,21,25)
InChIKeyZTIMUHZDJWKDBZ-UHFFFAOYSA-N
XLogP2.20
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-ethylbenzimidazol-2-yl)methyl]-N-methyl-1-pyridin-4-ylmethanamine
CID 84585943
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 17477086
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 18121498
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(2-methylphenyl)sulfanylacetamide
CID 18086685
2-(2,6-dichlorophenyl)-N-[(1-ethylbenzimidazol-2-yl)methyl]acetamide
CID 18116699
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
CID 18142627
N-[(1-ethylbenzimidazol-2-yl)methyl]cyclopropanecarboxamide
CID 16969775
2-[(1-ethylbenzimidazol-2-yl)methylamino]-N-methylacetamide
CID 60673139
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(2H-indazol-3-yl)acetamide
CID 49373016
1,3-bis(1-ethylbenzimidazol-2-yl)propan-2-one
CID 91072390
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-methyl-2-phenylpropanamide
CID 47012383
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 18093027

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
The IUPAC name of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide (CID 86285007) is N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide.
What is the SMILES notation for N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
The canonical SMILES for N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide is CCn1c(CNC(=O)CN(C)Cc2ccncc2)nc2ccccc21.
What is the InChIKey of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
The InChIKey is ZTIMUHZDJWKDBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-3-24-17-7-5-4-6-16(17)22-18(24)12-21-19(25)14-23(2)13-15-8-10-20-11-9-15/h4-11H,3,12-14H2,1-2H3,(H,21,25).
What are the key properties of N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide has a molecular weight of 337.43 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylbenzimidazol-2-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide is sourced from PubChem (CID 86285007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).