4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine

C18H24N2 — CID 81426138

IUPAC4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine
SMILESCC1CCCC(NCc2cccc3cccnc23)CC1
InChIInChI=1S/C18H24N2/c1-14-5-2-9-17(11-10-14)20-13-16-7-3-6-15-8-4-12-19-18(15)16/h3-4,6-8,12,14,17,20H,2,5,9-11,13H2,1H3
InChIKeyCZFVNRUZZZTTHI-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.29
Rot. Bonds3

About 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine

4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine (PubChem CID 81426138) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine.

Molecular Properties

Compound Name4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine
PubChem CID81426138
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine
SMILESCC1CCCC(NCc2cccc3cccnc23)CC1
InChIInChI=1S/C18H24N2/c1-14-5-2-9-17(11-10-14)20-13-16-7-3-6-15-8-4-12-19-18(15)16/h3-4,6-8,12,14,17,20H,2,5,9-11,13H2,1H3
InChIKeyCZFVNRUZZZTTHI-UHFFFAOYSA-N
XLogP4.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 79032434
3-(quinolin-8-ylmethylamino)cyclohexan-1-ol
CID 43751062
2,6-dimethyl-N-(quinolin-8-ylmethyl)piperidin-1-amine
CID 83007197
3-methylsulfanyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 103701386
2-methyl-N-(quinolin-8-ylmethyl)oxan-4-amine
CID 81428245
3,3-dimethyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 81428857
2-methoxy-N-(quinolin-8-ylmethyl)cyclohexan-1-amine
CID 79032067
N-[(2-methoxy-3-pyridinyl)methyl]-4-methylcyclohexan-1-amine
CID 54926984
2-methyl-N-(quinolin-8-ylmethyl)oxolan-3-amine
CID 115337151
4-methyl-N-(pyridin-2-ylmethyl)cycloheptan-1-amine
CID 65080736
1-prop-2-ynyl-N-(quinolin-8-ylmethyl)piperidin-4-amine
CID 81333275
2-methyl-6-[[(4-methylcycloheptyl)amino]methyl]phenol
CID 102809836

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine?
The IUPAC name of 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine (CID 81426138) is 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine.
What is the SMILES notation for 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine?
The canonical SMILES for 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine is CC1CCCC(NCc2cccc3cccnc23)CC1.
What is the InChIKey of 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine?
The InChIKey is CZFVNRUZZZTTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-14-5-2-9-17(11-10-14)20-13-16-7-3-6-15-8-4-12-19-18(15)16/h3-4,6-8,12,14,17,20H,2,5,9-11,13H2,1H3.
What are the key properties of 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine?
4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine is sourced from PubChem (CID 81426138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).