N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine

C22H24N4 — CID 68946542

IUPACN-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine
SMILESCC(NC1CC1)c1cccc(-c2ccc3ncnc(NC4CC4)c3c2)c1
InChIInChI=1S/C22H24N4/c1-14(25-18-6-7-18)15-3-2-4-16(11-15)17-5-10-21-20(12-17)22(24-13-23-21)26-19-8-9-19/h2-5,10-14,18-19,25H,6-9H2,1H3,(H,23,24,26)
InChIKeyQJTSJIUCYCAGMX-UHFFFAOYSA-N
MW344.46 g/mol
LogP4.68
Rot. Bonds6

About N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine

N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine (PubChem CID 68946542) has the molecular formula C22H24N4 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine
PubChem CID68946542
Molecular FormulaC22H24N4
Molecular Weight344.46 g/mol
Exact Mass344.20
IUPAC NameN-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine
SMILESCC(NC1CC1)c1cccc(-c2ccc3ncnc(NC4CC4)c3c2)c1
InChIInChI=1S/C22H24N4/c1-14(25-18-6-7-18)15-3-2-4-16(11-15)17-5-10-21-20(12-17)22(24-13-23-21)26-19-8-9-19/h2-5,10-14,18-19,25H,6-9H2,1H3,(H,23,24,26)
InChIKeyQJTSJIUCYCAGMX-UHFFFAOYSA-N
XLogP4.68
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-N-[1-[3-[4-(cyclopropylamino)quinazolin-6-yl]phenyl]ethyl]benzamide
CID 57435021
6-[3-(anilinomethyl)phenyl]-N-cyclopropylquinazolin-4-amine
CID 68942507
N-cyclopropyl-6-(2,5-dimethylphenyl)quinazolin-4-amine
CID 91256462
N-cyclopropyl-6-[3-(morpholin-4-ylmethyl)phenyl]quinazolin-4-amine
CID 68944579
5-[4-(cyclopropylamino)quinazolin-6-yl]-2-fluorobenzaldehyde
CID 57435174
6-chloro-N-cyclopropylquinazolin-4-amine
CID 13231191
1-[[3-[4-(cyclopropylamino)quinazolin-6-yl]phenyl]methyl]pyrrolidin-2-one;hydrochloride
CID 57435013
N-cyclopropyl-6-[3-[(cyclopropylamino)methyl]-4-methoxyphenyl]quinazolin-4-amine
CID 68943884
N-cyclopropyl-6-[3-[(cyclopropylamino)methyl]phenyl]quinazolin-4-amine;pentanoic acid
CID 172789188
1-N-methyl-4-N-[6-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinazolin-4-yl]cyclohexane-1,4-diamine
CID 121266064
4-methyl-6-(3-propan-2-ylphenyl)quinazoline
CID 71095396
4-N-(6-cyclopropylquinazolin-4-yl)-1-N-methylcyclohexane-1,4-diamine
CID 121263781

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine?
The IUPAC name of N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine (CID 68946542) is N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine.
What is the SMILES notation for N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine?
The canonical SMILES for N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine is CC(NC1CC1)c1cccc(-c2ccc3ncnc(NC4CC4)c3c2)c1.
What is the InChIKey of N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine?
The InChIKey is QJTSJIUCYCAGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4/c1-14(25-18-6-7-18)15-3-2-4-16(11-15)17-5-10-21-20(12-17)22(24-13-23-21)26-19-8-9-19/h2-5,10-14,18-19,25H,6-9H2,1H3,(H,23,24,26).
What are the key properties of N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine?
N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine has a molecular weight of 344.46 g/mol, XLogP of 4.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[3-[1-(cyclopropylamino)ethyl]phenyl]quinazolin-4-amine is sourced from PubChem (CID 68946542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).