4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine

C12H20N4 — CID 64830676

IUPAC4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine
SMILESCC(CC1CC1)Nc1ccnc(N(C)C)n1
InChIInChI=1S/C12H20N4/c1-9(8-10-4-5-10)14-11-6-7-13-12(15-11)16(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,13,14,15)
InChIKeyDJUHQZFTOPUXPR-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.14
Rot. Bonds5

About 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine

4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine (PubChem CID 64830676) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine
PubChem CID64830676
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine
SMILESCC(CC1CC1)Nc1ccnc(N(C)C)n1
InChIInChI=1S/C12H20N4/c1-9(8-10-4-5-10)14-11-6-7-13-12(15-11)16(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,13,14,15)
InChIKeyDJUHQZFTOPUXPR-UHFFFAOYSA-N
XLogP2.14
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-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

Frequently Asked Questions

What is the IUPAC name of 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine (CID 64830676) is 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine is CC(CC1CC1)Nc1ccnc(N(C)C)n1.
What is the InChIKey of 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine?
The InChIKey is DJUHQZFTOPUXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9(8-10-4-5-10)14-11-6-7-13-12(15-11)16(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,13,14,15).
What are the key properties of 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine?
4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine has a molecular weight of 220.32 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 64830676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).