N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide

C10H14N4O2 — CID 116626262

IUPACN-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
SMILESNC(=O)NC(=O)Cn1cnc2c1CCCC2
InChIInChI=1S/C10H14N4O2/c11-10(16)13-9(15)5-14-6-12-7-3-1-2-4-8(7)14/h6H,1-5H2,(H3,11,13,15,16)
InChIKeyJEPNPTYOAZNERD-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.04
Rot. Bonds2

About N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide

N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide (PubChem CID 116626262) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
PubChem CID116626262
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC NameN-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
SMILESNC(=O)NC(=O)Cn1cnc2c1CCCC2
InChIInChI=1S/C10H14N4O2/c11-10(16)13-9(15)5-14-6-12-7-3-1-2-4-8(7)14/h6H,1-5H2,(H3,11,13,15,16)
InChIKeyJEPNPTYOAZNERD-UHFFFAOYSA-N
XLogP-0.04
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(azepan-1-yl)-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)ethanone
CID 115944318
N-(2-methoxyethyl)-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
CID 115944319
N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
CID 115963996
1-morpholin-4-yl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)ethanone
CID 115944330
N-(5-phenyl-2-pyridinyl)-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
CID 138700717
N-carbamoyl-2-(4,5-dichloro-6-oxopyrimidin-1-yl)acetamide
CID 114582909
ethyl 2-[3-phenyl-5-[[2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetyl]amino]pyrazol-1-yl]acetate
CID 166205571
1,3-dimethyl-7-[2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)ethyl]purine-2,6-dione
CID 167796880
N-carbamoyl-2-(6,8-dibromo-4-oxoquinazolin-3-yl)acetamide
CID 9136137
5-[2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)ethylamino]pyrazine-2-carboxylic acid
CID 166302096
1-(3-fluoropropyl)-4,5,6,7-tetrahydrobenzimidazole
CID 116626451
N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
CID 146131196

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide?
The IUPAC name of N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide (CID 116626262) is N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide?
The canonical SMILES for N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide is NC(=O)NC(=O)Cn1cnc2c1CCCC2.
What is the InChIKey of N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide?
The InChIKey is JEPNPTYOAZNERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c11-10(16)13-9(15)5-14-6-12-7-3-1-2-4-8(7)14/h6H,1-5H2,(H3,11,13,15,16).
What are the key properties of N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide?
N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide has a molecular weight of 222.25 g/mol, XLogP of -0.04, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide is sourced from PubChem (CID 116626262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).