4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride

C18H23Cl2N5 — CID 19392165

IUPAC4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride
SMILESCNc1cccc2nc(-n3ccnc3)nc(C3CCCCC3)c12.Cl.Cl
InChIInChI=1S/C18H21N5.2ClH/c1-19-14-8-5-9-15-16(14)17(13-6-3-2-4-7-13)22-18(21-15)23-11-10-20-12-23;;/h5,8-13,19H,2-4,6-7H2,1H3;2*1H
InChIKeyZVOYMOMJHKIYNT-UHFFFAOYSA-N
MW380.32 g/mol
LogP4.75
Rot. Bonds3

About 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride

4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride (PubChem CID 19392165) has the molecular formula C18H23Cl2N5 and a molecular weight of 380.32 g/mol. Its IUPAC name is 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride.

Molecular Properties

Compound Name4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride
PubChem CID19392165
Molecular FormulaC18H23Cl2N5
Molecular Weight380.32 g/mol
Exact Mass379.13
IUPAC Name4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride
SMILESCNc1cccc2nc(-n3ccnc3)nc(C3CCCCC3)c12.Cl.Cl
InChIInChI=1S/C18H21N5.2ClH/c1-19-14-8-5-9-15-16(14)17(13-6-3-2-4-7-13)22-18(21-15)23-11-10-20-12-23;;/h5,8-13,19H,2-4,6-7H2,1H3;2*1H
InChIKeyZVOYMOMJHKIYNT-UHFFFAOYSA-N
XLogP4.75
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.32
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride?
The IUPAC name of 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride (CID 19392165) is 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride.
What is the SMILES notation for 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride?
The canonical SMILES for 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride is CNc1cccc2nc(-n3ccnc3)nc(C3CCCCC3)c12.Cl.Cl.
What is the InChIKey of 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride?
The InChIKey is ZVOYMOMJHKIYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5.2ClH/c1-19-14-8-5-9-15-16(14)17(13-6-3-2-4-7-13)22-18(21-15)23-11-10-20-12-23;;/h5,8-13,19H,2-4,6-7H2,1H3;2*1H.
What are the key properties of 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride?
4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride has a molecular weight of 380.32 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-2-imidazol-1-yl-N-methylquinazolin-5-amine;dihydrochloride is sourced from PubChem (CID 19392165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).