N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide

C7H13N3O — CID 20684092

IUPACN,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide
SMILESCNC(=O)C1=C(C)NC(C)N1
InChIInChI=1S/C7H13N3O/c1-4-6(7(11)8-3)10-5(2)9-4/h5,9-10H,1-3H3,(H,8,11)
InChIKeyPUXSQTMAUGFKED-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.50
Rot. Bonds1

About N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide

N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide (PubChem CID 20684092) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide.

Molecular Properties

Compound NameN,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide
PubChem CID20684092
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC NameN,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide
SMILESCNC(=O)C1=C(C)NC(C)N1
InChIInChI=1S/C7H13N3O/c1-4-6(7(11)8-3)10-5(2)9-4/h5,9-10H,1-3H3,(H,8,11)
InChIKeyPUXSQTMAUGFKED-UHFFFAOYSA-N
XLogP-0.50
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide?
The IUPAC name of N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide (CID 20684092) is N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide.
What is the SMILES notation for N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide?
The canonical SMILES for N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide is CNC(=O)C1=C(C)NC(C)N1.
What is the InChIKey of N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide?
The InChIKey is PUXSQTMAUGFKED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-4-6(7(11)8-3)10-5(2)9-4/h5,9-10H,1-3H3,(H,8,11).
What are the key properties of N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide?
N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide has a molecular weight of 155.20 g/mol, XLogP of -0.50, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,5-trimethyl-2,3-dihydro-1H-imidazole-4-carboxamide is sourced from PubChem (CID 20684092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).