3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine

C16H20N2 — CID 81216679

IUPAC3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine
SMILESCC1(C)CCC(N)(c2cccc3cccnc23)C1
InChIInChI=1S/C16H20N2/c1-15(2)8-9-16(17,11-15)13-7-3-5-12-6-4-10-18-14(12)13/h3-7,10H,8-9,11,17H2,1-2H3
InChIKeyKUJLQAJMAJDDCA-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.60
Rot. Bonds1

About 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine

3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine (PubChem CID 81216679) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine
PubChem CID81216679
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine
SMILESCC1(C)CCC(N)(c2cccc3cccnc23)C1
InChIInChI=1S/C16H20N2/c1-15(2)8-9-16(17,11-15)13-7-3-5-12-6-4-10-18-14(12)13/h3-7,10H,8-9,11,17H2,1-2H3
InChIKeyKUJLQAJMAJDDCA-UHFFFAOYSA-N
XLogP3.60
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine (CID 81216679) is 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine is CC1(C)CCC(N)(c2cccc3cccnc23)C1.
What is the InChIKey of 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine?
The InChIKey is KUJLQAJMAJDDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-15(2)8-9-16(17,11-15)13-7-3-5-12-6-4-10-18-14(12)13/h3-7,10H,8-9,11,17H2,1-2H3.
What are the key properties of 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine?
3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-quinolin-8-ylcyclopentan-1-amine is sourced from PubChem (CID 81216679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).