N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine

C17H26N2 — CID 55069946

IUPACN-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine
SMILESc1ccc2c(c1)CCCN2CCCCCNC1CC1
InChIInChI=1S/C17H26N2/c1(4-12-18-16-10-11-16)5-13-19-14-6-8-15-7-2-3-9-17(15)19/h2-3,7,9,16,18H,1,4-6,8,10-14H2
InChIKeyVLCYUEXIMLAYGT-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.36
Rot. Bonds7

About N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine

N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine (PubChem CID 55069946) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine
PubChem CID55069946
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine
SMILESc1ccc2c(c1)CCCN2CCCCCNC1CC1
InChIInChI=1S/C17H26N2/c1(4-12-18-16-10-11-16)5-13-19-14-6-8-15-7-2-3-9-17(15)19/h2-3,7,9,16,18H,1,4-6,8,10-14H2
InChIKeyVLCYUEXIMLAYGT-UHFFFAOYSA-N
XLogP3.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(2,3-dihydroindol-1-yl)propyl]cyclopropanamine
CID 60867490
4-(3,4-dihydro-2H-quinolin-1-yl)-N-methylbutan-1-amine
CID 60840995
N-[4-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)butyl]cyclopropanamine
CID 63153176
N-[3-(2,3-dihydroindol-1-yl)propyl]piperidin-4-amine
CID 54902685
N-[2-(2,3-dihydroindol-1-yl)ethyl]cyclopentanamine
CID 55024431
1-heptyl-3,4-dihydro-2H-quinoline
CID 154324891
8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
CID 13472131
6-(3,4-dihydro-2H-quinolin-1-yl)hexan-1-amine
CID 13472128
5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 13472126
4-[4-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]piperidin-1-yl]-6-methylpyrimidin-2-amine
CID 72916033
6-(3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylhexan-1-amine
CID 13472124
8-(3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethyloctan-1-amine
CID 13472133

Frequently Asked Questions

What is the IUPAC name of N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine?
The IUPAC name of N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine (CID 55069946) is N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine.
What is the SMILES notation for N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine?
The canonical SMILES for N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine is c1ccc2c(c1)CCCN2CCCCCNC1CC1.
What is the InChIKey of N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine?
The InChIKey is VLCYUEXIMLAYGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1(4-12-18-16-10-11-16)5-13-19-14-6-8-15-7-2-3-9-17(15)19/h2-3,7,9,16,18H,1,4-6,8,10-14H2.
What are the key properties of N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine?
N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine has a molecular weight of 258.41 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine is sourced from PubChem (CID 55069946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).