N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine

C9H13N5 — CID 122695698

IUPACN,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine
SMILESCNc1nc(-c2ncc(C)[nH]2)cn1C
InChIInChI=1S/C9H13N5/c1-6-4-11-8(12-6)7-5-14(3)9(10-2)13-7/h4-5H,1-3H3,(H,10,13)(H,11,12)
InChIKeyXYMVYUSYSOKUSZ-UHFFFAOYSA-N
MW191.24 g/mol
LogP1.16
Rot. Bonds2

About N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine

N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine (PubChem CID 122695698) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine.

Molecular Properties

Compound NameN,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine
PubChem CID122695698
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC NameN,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine
SMILESCNc1nc(-c2ncc(C)[nH]2)cn1C
InChIInChI=1S/C9H13N5/c1-6-4-11-8(12-6)7-5-14(3)9(10-2)13-7/h4-5H,1-3H3,(H,10,13)(H,11,12)
InChIKeyXYMVYUSYSOKUSZ-UHFFFAOYSA-N
XLogP1.16
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

MAT-POS-ea426761-49
CID 56864220
4-propyl-1H-imidazo[2,1-f]purin-5-one
CID 10536740
2-(4-1H-imidazolyl)-4-trifluoromethyl-1H-imidazole
CID 10488302
2-(1H-imidazol-2-yl)-3-methylimidazole-4-carbonitrile
CID 19877956
2-(1H-imidazol-2-yl)-5-methyl-1H-imidazole
CID 44339795
2-(1H-imidazol-5-yl)-1H-imidazole-5-carbonitrile
CID 44339902
2-(1H-imidazol-2-yl)-1-methylimidazole-4-carbonitrile
CID 135708785
(1H-imidazol-4-ylmethyl)(methyl)amine
CID 20675588
((1-methyl-1H-imidazol-5-yl)methyl)(propan-2-yl)amine
CID 59237459
ethyl[(1-methyl-1H-imidazol-5-yl)methyl]amine
CID 59746123
2-(1-methylimidazol-2-yl)-1H-imidazole-5-carbonitrile
CID 13663755
2-(1H-imidazol-5-ylmethyl)guanidine
CID 44331454

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine?
The IUPAC name of N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine (CID 122695698) is N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine.
What is the SMILES notation for N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine?
The canonical SMILES for N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine is CNc1nc(-c2ncc(C)[nH]2)cn1C.
What is the InChIKey of N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine?
The InChIKey is XYMVYUSYSOKUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-6-4-11-8(12-6)7-5-14(3)9(10-2)13-7/h4-5H,1-3H3,(H,10,13)(H,11,12).
What are the key properties of N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine?
N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine has a molecular weight of 191.24 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-4-(5-methyl-1H-imidazol-2-yl)imidazol-2-amine is sourced from PubChem (CID 122695698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).