(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine

C17H22N2 — CID 81395320

IUPAC(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine
SMILESC[C@@H](NCc1ccc2ccccc2n1)C1CCCC1
InChIInChI=1S/C17H22N2/c1-13(14-6-2-3-7-14)18-12-16-11-10-15-8-4-5-9-17(15)19-16/h4-5,8-11,13-14,18H,2-3,6-7,12H2,1H3/t13-/m1/s1
InChIKeyJJBFPMFRFIAWOI-CYBMUJFWSA-N
MW254.38 g/mol
LogP3.90
Rot. Bonds4

About (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine

(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine (PubChem CID 81395320) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine
PubChem CID81395320
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine
SMILESC[C@@H](NCc1ccc2ccccc2n1)C1CCCC1
InChIInChI=1S/C17H22N2/c1-13(14-6-2-3-7-14)18-12-16-11-10-15-8-4-5-9-17(15)19-16/h4-5,8-11,13-14,18H,2-3,6-7,12H2,1H3/t13-/m1/s1
InChIKeyJJBFPMFRFIAWOI-CYBMUJFWSA-N
XLogP3.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(quinolin-2-ylmethylamino)propan-1-ol
CID 93083144
N-(quinolin-2-ylmethyl)cyclohexanamine
CID 28774764
trans-(1S,2S)-1-N,2-N-bis(quinolin-2-ylmethyl)cyclohexane-1,2-diamine
CID 70905536
N-(quinolin-2-ylmethyl)butan-2-amine
CID 43183332
(1S)-1-cycloheptyl-N-(pyridin-2-ylmethyl)ethanamine
CID 81391298
N-(1,3-benzothiazol-2-ylmethyl)-1-cyclopentylethanamine
CID 62632788
4-methyl-N-(quinolin-2-ylmethyl)pentan-2-amine
CID 43372170
2-methyl-N-(quinolin-2-ylmethyl)pentan-3-amine
CID 54954967
N-(quinolin-2-ylmethyl)pentan-3-amine
CID 28774778
1-methylsulfanyl-N-(quinolin-2-ylmethyl)propan-2-amine
CID 115654305
1-[[[(1R)-1-cyclopentylethyl]amino]methyl]naphthalen-2-ol
CID 81394953
1-cyclohexyl-N-(naphthalen-1-ylmethyl)ethanamine
CID 63477824

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine?
The IUPAC name of (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine (CID 81395320) is (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine.
What is the SMILES notation for (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine?
The canonical SMILES for (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine is C[C@@H](NCc1ccc2ccccc2n1)C1CCCC1.
What is the InChIKey of (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine?
The InChIKey is JJBFPMFRFIAWOI-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H22N2/c1-13(14-6-2-3-7-14)18-12-16-11-10-15-8-4-5-9-17(15)19-16/h4-5,8-11,13-14,18H,2-3,6-7,12H2,1H3/t13-/m1/s1.
What are the key properties of (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine?
(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine is sourced from PubChem (CID 81395320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).