4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine

C18H24N2 — CID 81222924

IUPAC4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine
SMILESCC(C)C1CCC(N)C(c2ccc3cccnc3c2)C1
InChIInChI=1S/C18H24N2/c1-12(2)14-7-8-17(19)16(10-14)15-6-5-13-4-3-9-20-18(13)11-15/h3-6,9,11-12,14,16-17H,7-8,10,19H2,1-2H3
InChIKeyZYKBDKYFCQQPSF-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.10
Rot. Bonds2

About 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine

4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine (PubChem CID 81222924) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine.

Molecular Properties

Compound Name4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine
PubChem CID81222924
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine
SMILESCC(C)C1CCC(N)C(c2ccc3cccnc3c2)C1
InChIInChI=1S/C18H24N2/c1-12(2)14-7-8-17(19)16(10-14)15-6-5-13-4-3-9-20-18(13)11-15/h3-6,9,11-12,14,16-17H,7-8,10,19H2,1-2H3
InChIKeyZYKBDKYFCQQPSF-UHFFFAOYSA-N
XLogP4.10
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine?
The IUPAC name of 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine (CID 81222924) is 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine.
What is the SMILES notation for 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine?
The canonical SMILES for 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine is CC(C)C1CCC(N)C(c2ccc3cccnc3c2)C1.
What is the InChIKey of 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine?
The InChIKey is ZYKBDKYFCQQPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-12(2)14-7-8-17(19)16(10-14)15-6-5-13-4-3-9-20-18(13)11-15/h3-6,9,11-12,14,16-17H,7-8,10,19H2,1-2H3.
What are the key properties of 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine?
4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-2-quinolin-7-ylcyclohexan-1-amine is sourced from PubChem (CID 81222924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).