4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine

C13H19N5 — CID 133407373

IUPAC4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine
SMILESCCCCN(CC)c1ncnc2nc(N)ccc12
InChIInChI=1S/C13H19N5/c1-3-5-8-18(4-2)13-10-6-7-11(14)17-12(10)15-9-16-13/h6-7,9H,3-5,8H2,1-2H3,(H2,14,15,16,17)
InChIKeyZYRHSYRLCPRXGA-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.23
Rot. Bonds5

About 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine

4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine (PubChem CID 133407373) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine.

Molecular Properties

Compound Name4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine
PubChem CID133407373
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine
SMILESCCCCN(CC)c1ncnc2nc(N)ccc12
InChIInChI=1S/C13H19N5/c1-3-5-8-18(4-2)13-10-6-7-11(14)17-12(10)15-9-16-13/h6-7,9H,3-5,8H2,1-2H3,(H2,14,15,16,17)
InChIKeyZYRHSYRLCPRXGA-UHFFFAOYSA-N
XLogP2.23
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-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

4-N,4-N-bis(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine
CID 127655233
N-butyl-N-ethylquinazolin-4-amine
CID 110433588
4-N-butyl-4-N,5-diethylpyrimidine-4,6-diamine
CID 80754266
N-butyl-N-ethyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 4060711
N-butyl-6-chloro-N-ethyl-5-methylpyrimidin-4-amine
CID 63735068
4-N-[2-(N-ethyl-3-methylanilino)ethyl]pyrido[2,3-d]pyrimidine-4,7-diamine
CID 133407866
4-N-[(1S,3R)-2,2-diethyl-3-methoxycyclobutyl]-4-N-methylpyrido[2,3-d]pyrimidine-4,7-diamine
CID 97101821
N-butyl-N-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-amine
CID 55346583
4-N-butyl-4-N,6-N-diethyl-5-methylpyrimidine-4,6-diamine
CID 80757752
4-N-butyl-4-N-ethyl-5-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80753718
2-[butyl(quinazolin-4-yl)amino]ethanol
CID 61448133
2-[(6-amino-3-pyridinyl)-butylamino]ethanol
CID 61444320

Frequently Asked Questions

What is the IUPAC name of 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine?
The IUPAC name of 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine (CID 133407373) is 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine.
What is the SMILES notation for 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine?
The canonical SMILES for 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine is CCCCN(CC)c1ncnc2nc(N)ccc12.
What is the InChIKey of 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine?
The InChIKey is ZYRHSYRLCPRXGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-3-5-8-18(4-2)13-10-6-7-11(14)17-12(10)15-9-16-13/h6-7,9H,3-5,8H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine?
4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine has a molecular weight of 245.33 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-butyl-4-N-ethylpyrido[2,3-d]pyrimidine-4,7-diamine is sourced from PubChem (CID 133407373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).