4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine

C13H18N4 — CID 80765400

IUPAC4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine
SMILESCCCNc1nc(N(C)C)c2ccccc2n1
InChIInChI=1S/C13H18N4/c1-4-9-14-13-15-11-8-6-5-7-10(11)12(16-13)17(2)3/h5-8H,4,9H2,1-3H3,(H,14,15,16)
InChIKeyGANFXUAVJWXSKN-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.52
Rot. Bonds4

About 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine

4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine (PubChem CID 80765400) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine.

Molecular Properties

Compound Name4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine
PubChem CID80765400
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine
SMILESCCCNc1nc(N(C)C)c2ccccc2n1
InChIInChI=1S/C13H18N4/c1-4-9-14-13-15-11-8-6-5-7-10(11)12(16-13)17(2)3/h5-8H,4,9H2,1-3H3,(H,14,15,16)
InChIKeyGANFXUAVJWXSKN-UHFFFAOYSA-N
XLogP2.52
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine
CID 80774231
2-N-ethyl-4-N,4-N-dipropylquinazoline-2,4-diamine
CID 80763784
N,N-dimethyl-2-[[2-(propylamino)quinazolin-4-yl]amino]acetamide
CID 80771008
2-N,4-N-dimethyl-4-N-propylquinazoline-2,4-diamine
CID 80776135
2-N-ethyl-4-N-methyl-4-N-(2-methylpropyl)quinazoline-2,4-diamine
CID 80776501
4-N-(3-methylbutan-2-yl)-2-N-propylquinazoline-2,4-diamine
CID 80753533
2-N-ethyl-4-N-methyl-4-N-(3-methylbutan-2-yl)quinazoline-2,4-diamine
CID 80793521
2-N-propyl-4-N-(2,2,2-trifluoroethyl)quinazoline-2,4-diamine
CID 80778175
4-N-butyl-2-N,4-N-diethylquinazoline-2,4-diamine
CID 80754270
N-butylsulfanylmethanamine;2-N-(cyclohexylmethyl)-4-N,4-N-dimethylquinazoline-2,4-diamine
CID 142228536
2-N-methyl-4-N,4-N-dipropylquinazoline-2,4-diamine
CID 80764587
4-(3-methylbutylsulfanyl)-N-propylquinazolin-2-amine
CID 107765966

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine?
The IUPAC name of 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine (CID 80765400) is 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine.
What is the SMILES notation for 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine?
The canonical SMILES for 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine is CCCNc1nc(N(C)C)c2ccccc2n1.
What is the InChIKey of 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine?
The InChIKey is GANFXUAVJWXSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-4-9-14-13-15-11-8-6-5-7-10(11)12(16-13)17(2)3/h5-8H,4,9H2,1-3H3,(H,14,15,16).
What are the key properties of 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine?
4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine has a molecular weight of 230.31 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine is sourced from PubChem (CID 80765400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).