N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine

C17H26N2 — CID 43541283

IUPACN-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine
SMILESCCN(Cc1ccc2c(c1)CCCN2)C1CCCC1
InChIInChI=1S/C17H26N2/c1-2-19(16-7-3-4-8-16)13-14-9-10-17-15(12-14)6-5-11-18-17/h9-10,12,16,18H,2-8,11,13H2,1H3
InChIKeyDWLMTQSMKQHTAP-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.81
Rot. Bonds4

About N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine

N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine (PubChem CID 43541283) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine
PubChem CID43541283
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine
SMILESCCN(Cc1ccc2c(c1)CCCN2)C1CCCC1
InChIInChI=1S/C17H26N2/c1-2-19(16-7-3-4-8-16)13-14-9-10-17-15(12-14)6-5-11-18-17/h9-10,12,16,18H,2-8,11,13H2,1H3
InChIKeyDWLMTQSMKQHTAP-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-propylcyclopropanamine
CID 43270522
1-cyclobutyl-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 62861548
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine
CID 55001070
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 54946789
N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine
CID 81215049
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-ethylethanamine
CID 22898575
6-(cyclobutylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106779249
N-cyclohexyl-N-ethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 43325599
N-cycloheptyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine
CID 81215282
N-propan-2-yl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-1-amine
CID 43269701
2-ethoxy-N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
CID 55227894
6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline
CID 114192887

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine?
The IUPAC name of N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine (CID 43541283) is N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine?
The canonical SMILES for N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine is CCN(Cc1ccc2c(c1)CCCN2)C1CCCC1.
What is the InChIKey of N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine?
The InChIKey is DWLMTQSMKQHTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-2-19(16-7-3-4-8-16)13-14-9-10-17-15(12-14)6-5-11-18-17/h9-10,12,16,18H,2-8,11,13H2,1H3.
What are the key properties of N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine?
N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine has a molecular weight of 258.41 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cyclopentanamine is sourced from PubChem (CID 43541283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).