N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide

C11H11N5O — CID 89488497

IUPACN-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide
SMILESO=C(c1ncccn1)N(c1ncc[nH]1)C1CC1
InChIInChI=1S/C11H11N5O/c17-10(9-12-4-1-5-13-9)16(8-2-3-8)11-14-6-7-15-11/h1,4-8H,2-3H2,(H,14,15)
InChIKeyAUIJWWNHMBDBMA-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.01
Rot. Bonds3

About N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide

N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide (PubChem CID 89488497) has the molecular formula C11H11N5O and a molecular weight of 229.24 g/mol. Its IUPAC name is N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide
PubChem CID89488497
Molecular FormulaC11H11N5O
Molecular Weight229.24 g/mol
Exact Mass229.10
IUPAC NameN-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide
SMILESO=C(c1ncccn1)N(c1ncc[nH]1)C1CC1
InChIInChI=1S/C11H11N5O/c17-10(9-12-4-1-5-13-9)16(8-2-3-8)11-14-6-7-15-11/h1,4-8H,2-3H2,(H,14,15)
InChIKeyAUIJWWNHMBDBMA-UHFFFAOYSA-N
XLogP1.01
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide (CID 89488497) is N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide is O=C(c1ncccn1)N(c1ncc[nH]1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide?
The InChIKey is AUIJWWNHMBDBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O/c17-10(9-12-4-1-5-13-9)16(8-2-3-8)11-14-6-7-15-11/h1,4-8H,2-3H2,(H,14,15).
What are the key properties of N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide?
N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(1H-imidazol-2-yl)pyrimidine-2-carboxamide is sourced from PubChem (CID 89488497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).