1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea

C17H21N7O — CID 154770903

IUPAC1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
SMILESCc1nc2ccccn2c1CNC(=O)NCc1ccnc(N(C)C)n1
InChIInChI=1S/C17H21N7O/c1-12-14(24-9-5-4-6-15(24)21-12)11-20-17(25)19-10-13-7-8-18-16(22-13)23(2)3/h4-9H,10-11H2,1-3H3,(H2,19,20,25)
InChIKeyNGCDVVXYQGMQSF-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.50
Rot. Bonds5

About 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea

1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea (PubChem CID 154770903) has the molecular formula C17H21N7O and a molecular weight of 339.40 g/mol. Its IUPAC name is 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea.

Molecular Properties

Compound Name1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
PubChem CID154770903
Molecular FormulaC17H21N7O
Molecular Weight339.40 g/mol
Exact Mass339.18
IUPAC Name1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
SMILESCc1nc2ccccn2c1CNC(=O)NCc1ccnc(N(C)C)n1
InChIInChI=1S/C17H21N7O/c1-12-14(24-9-5-4-6-15(24)21-12)11-20-17(25)19-10-13-7-8-18-16(22-13)23(2)3/h4-9H,10-11H2,1-3H3,(H2,19,20,25)
InChIKeyNGCDVVXYQGMQSF-UHFFFAOYSA-N
XLogP1.50
TPSA87.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea 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

(2-methylimidazo[1,2-a]pyridin-3-yl)methylurea
CID 139728346
1-(1H-indol-2-ylmethyl)-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
CID 146077167
1-[(1-tert-butylazetidin-2-yl)methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
CID 138019683
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenyl)acetamide
CID 75400804
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]isoquinoline-1-carboxamide
CID 122354329
1-[(1R,2R)-2-(furan-2-yl)cyclopropyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
CID 138019543
1-(3-methoxy-1-methylpyrazol-4-yl)-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
CID 138054278
1-[[6-(dimethylamino)-2-pyridinyl]methyl]-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)urea
CID 75388974
1-(1-benzofuran-2-ylmethyl)-1-methyl-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea
CID 146103401
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
CID 119066175
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]pyridin-2-amine
CID 84758728
N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 122356267

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea?
The IUPAC name of 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea (CID 154770903) is 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea.
What is the SMILES notation for 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea?
The canonical SMILES for 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea is Cc1nc2ccccn2c1CNC(=O)NCc1ccnc(N(C)C)n1.
What is the InChIKey of 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea?
The InChIKey is NGCDVVXYQGMQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N7O/c1-12-14(24-9-5-4-6-15(24)21-12)11-20-17(25)19-10-13-7-8-18-16(22-13)23(2)3/h4-9H,10-11H2,1-3H3,(H2,19,20,25).
What are the key properties of 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea?
1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea has a molecular weight of 339.40 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-3-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]urea is sourced from PubChem (CID 154770903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).