2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine

C18H25N3 — CID 81427255

IUPAC2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine
SMILESNCC1CCCCC1NCCc1cccc2cccnc12
InChIInChI=1S/C18H25N3/c19-13-16-5-1-2-9-17(16)20-12-10-15-7-3-6-14-8-4-11-21-18(14)15/h3-4,6-8,11,16-17,20H,1-2,5,9-10,12-13,19H2
InChIKeyWZDVJIPYPQLGNL-UHFFFAOYSA-N
MW283.42 g/mol
LogP2.88
Rot. Bonds5

About 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine

2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine (PubChem CID 81427255) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine
PubChem CID81427255
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine
SMILESNCC1CCCCC1NCCc1cccc2cccnc12
InChIInChI=1S/C18H25N3/c19-13-16-5-1-2-9-17(16)20-12-10-15-7-3-6-14-8-4-11-21-18(14)15/h3-4,6-8,11,16-17,20H,1-2,5,9-10,12-13,19H2
InChIKeyWZDVJIPYPQLGNL-UHFFFAOYSA-N
XLogP2.88
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-(2-quinolin-8-ylethyl)cyclopentan-1-amine
CID 115708839
trans-(1R,2R)-2-(2-quinolin-8-ylethylamino)cyclopentan-1-ol
CID 102733860
2,6-dimethyl-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine
CID 81428785
N-(2-quinolin-8-ylethyl)thian-4-amine
CID 112727581
2-(aminomethyl)-N-[2-(2-methylphenyl)ethyl]cyclopentan-1-amine
CID 79763759
(3R,4R)-1,4-dimethyl-N-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
CID 97223040
N-(2-quinolin-8-ylethyl)cyclohexanecarboxamide
CID 18149258
1-ethyl-N-(2-quinolin-8-ylethyl)piperidin-4-amine
CID 81297387
N-methyl-2-quinolin-8-ylethanamine
CID 62549686
1-cyclopropyl-N-(2-quinolin-8-ylethyl)ethanamine
CID 79692541
2-methoxy-N-(quinolin-8-ylmethyl)cyclohexan-1-amine
CID 79032067
N-(2-quinolin-8-ylethyl)-1,2,4-thiadiazol-5-amine
CID 81428446

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine (CID 81427255) is 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine is NCC1CCCCC1NCCc1cccc2cccnc12.
What is the InChIKey of 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine?
The InChIKey is WZDVJIPYPQLGNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c19-13-16-5-1-2-9-17(16)20-12-10-15-7-3-6-14-8-4-11-21-18(14)15/h3-4,6-8,11,16-17,20H,1-2,5,9-10,12-13,19H2.
What are the key properties of 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine?
2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-quinolin-8-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 81427255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).