4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine

C18H24N4 — CID 121263781

IUPAC4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine
SMILESCNC1CCC(Nc2ncnc3ccc(C4CC4)cc23)CC1
InChIInChI=1S/C18H24N4/c1-19-14-5-7-15(8-6-14)22-18-16-10-13(12-2-3-12)4-9-17(16)20-11-21-18/h4,9-12,14-15,19H,2-3,5-8H2,1H3,(H,20,21,22)
InChIKeyCZARGARFFIFZDO-UHFFFAOYSA-N
MW296.42 g/mol
LogP3.45
Rot. Bonds4

About 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine

4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine (PubChem CID 121263781) has the molecular formula C18H24N4 and a molecular weight of 296.42 g/mol. Its IUPAC name is 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine.

Molecular Properties

Compound Name4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine
PubChem CID121263781
Molecular FormulaC18H24N4
Molecular Weight296.42 g/mol
Exact Mass296.20
IUPAC Name4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine
SMILESCNC1CCC(Nc2ncnc3ccc(C4CC4)cc23)CC1
InChIInChI=1S/C18H24N4/c1-19-14-5-7-15(8-6-14)22-18-16-10-13(12-2-3-12)4-9-17(16)20-11-21-18/h4,9-12,14-15,19H,2-3,5-8H2,1H3,(H,20,21,22)
InChIKeyCZARGARFFIFZDO-UHFFFAOYSA-N
XLogP3.45
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-cyclopropylquinazolin-4-amine
CID 13231191
6-chloro-N-cyclobutylquinazolin-4-amine
CID 13231187
1-N-methyl-4-N-[6-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinazolin-4-yl]cyclohexane-1,4-diamine
CID 121266064
6-chloro-N-cyclohexylquinazolin-4-amine
CID 13231193
4-[(6-aminoquinazolin-4-yl)amino]cyclohexan-1-ol
CID 64587470
N-cyclohexyl-6-ethylquinazolin-4-amine
CID 21002570
N-cyclopropyl-6-(2,5-dimethylphenyl)quinazolin-4-amine
CID 91256462
N-[4-(3-fluoroazetidin-1-yl)cyclohexyl]-6-methylquinazolin-4-amine
CID 121255023
4-[(4-aminocyclohexyl)amino]quinazoline-6-carbonitrile
CID 121262387
N-cyclopropyl-6-[3-[(cyclopropylamino)methyl]-4-methoxyphenyl]quinazolin-4-amine
CID 68943884
1-N-methyl-4-N-(6-methylthieno[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine
CID 79110936
N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine
CID 68946542

Frequently Asked Questions

What is the IUPAC name of 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine?
The IUPAC name of 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine (CID 121263781) is 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine.
What is the SMILES notation for 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine?
The canonical SMILES for 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine is CNC1CCC(Nc2ncnc3ccc(C4CC4)cc23)CC1.
What is the InChIKey of 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine?
The InChIKey is CZARGARFFIFZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4/c1-19-14-5-7-15(8-6-14)22-18-16-10-13(12-2-3-12)4-9-17(16)20-11-21-18/h4,9-12,14-15,19H,2-3,5-8H2,1H3,(H,20,21,22).
What are the key properties of 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine?
4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine has a molecular weight of 296.42 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine is sourced from PubChem (CID 121263781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).