N-cyclohexyl-4-methylquinazolin-2-amine

C15H19N3 — CID 118714792

IUPACN-cyclohexyl-4-methylquinazolin-2-amine
SMILESCc1nc(NC2CCCCC2)nc2ccccc12
InChIInChI=1S/C15H19N3/c1-11-13-9-5-6-10-14(13)18-15(16-11)17-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,16,17,18)
InChIKeyGCXCEKAHFJFISO-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.68
Rot. Bonds2

About N-cyclohexyl-4-methylquinazolin-2-amine

N-cyclohexyl-4-methylquinazolin-2-amine (PubChem CID 118714792) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-cyclohexyl-4-methylquinazolin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-methylquinazolin-2-amine
PubChem CID118714792
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-cyclohexyl-4-methylquinazolin-2-amine
SMILESCc1nc(NC2CCCCC2)nc2ccccc12
InChIInChI=1S/C15H19N3/c1-11-13-9-5-6-10-14(13)18-15(16-11)17-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,16,17,18)
InChIKeyGCXCEKAHFJFISO-UHFFFAOYSA-N
XLogP3.68
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methylquinazolin-2-amine?
The IUPAC name of N-cyclohexyl-4-methylquinazolin-2-amine (CID 118714792) is N-cyclohexyl-4-methylquinazolin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-methylquinazolin-2-amine?
The canonical SMILES for N-cyclohexyl-4-methylquinazolin-2-amine is Cc1nc(NC2CCCCC2)nc2ccccc12.
What is the InChIKey of N-cyclohexyl-4-methylquinazolin-2-amine?
The InChIKey is GCXCEKAHFJFISO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-13-9-5-6-10-14(13)18-15(16-11)17-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,16,17,18).
What are the key properties of N-cyclohexyl-4-methylquinazolin-2-amine?
N-cyclohexyl-4-methylquinazolin-2-amine has a molecular weight of 241.34 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methylquinazolin-2-amine is sourced from PubChem (CID 118714792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).