2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine

C21H21N5O — CID 154078899

IUPAC2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine
SMILESCc1oc2nc(N(C)C)nc(NCc3ccccn3)c2c1-c1ccccc1
InChIInChI=1S/C21H21N5O/c1-14-17(15-9-5-4-6-10-15)18-19(23-13-16-11-7-8-12-22-16)24-21(26(2)3)25-20(18)27-14/h4-12H,13H2,1-3H3,(H,23,24,25)
InChIKeyXWOIKXQEATXLKX-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.27
Rot. Bonds5

About 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine

2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine (PubChem CID 154078899) has the molecular formula C21H21N5O and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine
PubChem CID154078899
Molecular FormulaC21H21N5O
Molecular Weight359.43 g/mol
Exact Mass359.17
IUPAC Name2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine
SMILESCc1oc2nc(N(C)C)nc(NCc3ccccn3)c2c1-c1ccccc1
InChIInChI=1S/C21H21N5O/c1-14-17(15-9-5-4-6-10-15)18-19(23-13-16-11-7-8-12-22-16)24-21(26(2)3)25-20(18)27-14/h4-12H,13H2,1-3H3,(H,23,24,25)
InChIKeyXWOIKXQEATXLKX-UHFFFAOYSA-N
XLogP4.27
TPSA67.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine 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-N,2-N-dimethyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 64829086
ethyl 2,6-dimethyl-4-(pyridin-2-ylmethylamino)furo[2,3-d]pyrimidine-5-carboxylate
CID 20924992
2-[6-methyl-5-phenyl-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidin-2-yl]propane-1,3-diol
CID 67382100
N-ethyl-6-methyl-4-(pyridin-2-ylmethylamino)furo[2,3-d]pyrimidine-5-carboxamide
CID 118264766
5-phenyl-2-[(E)-prop-1-enyl]-N-(pyridin-2-ylmethyl)quinazolin-4-amine
CID 126518660
2-methyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine chloride
CID 53346777
5-methyl-2-N,4-N-bis(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 71922543
4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 20622527
2-phenyl-N-(pyridin-2-ylmethyl)quinazolin-4-amine
CID 4880961
4-(4-phenylphenyl)-N-(pyridin-2-ylmethyl)aniline
CID 101246794
2-[2-(dimethylamino)ethoxy]-5-phenyl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 68622417
6-methyl-2-N-(pyridin-2-ylmethyl)pyridine-2,3-diamine
CID 81132178

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine (CID 154078899) is 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine is Cc1oc2nc(N(C)C)nc(NCc3ccccn3)c2c1-c1ccccc1.
What is the InChIKey of 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is XWOIKXQEATXLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N5O/c1-14-17(15-9-5-4-6-10-15)18-19(23-13-16-11-7-8-12-22-16)24-21(26(2)3)25-20(18)27-14/h4-12H,13H2,1-3H3,(H,23,24,25).
What are the key properties of 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine?
2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 359.43 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-trimethyl-5-phenyl-4-N-(pyridin-2-ylmethyl)furo[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 154078899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).