N-(3-quinolin-7-yloxypropyl)aniline

C18H18N2O — CID 107315213

IUPACN-(3-quinolin-7-yloxypropyl)aniline
SMILESc1ccc(NCCCOc2ccc3cccnc3c2)cc1
InChIInChI=1S/C18H18N2O/c1-2-7-16(8-3-1)19-12-5-13-21-17-10-9-15-6-4-11-20-18(15)14-17/h1-4,6-11,14,19H,5,12-13H2
InChIKeyUCQNQGATWLOYOS-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.12
Rot. Bonds6

About N-(3-quinolin-7-yloxypropyl)aniline

N-(3-quinolin-7-yloxypropyl)aniline (PubChem CID 107315213) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-(3-quinolin-7-yloxypropyl)aniline.

Molecular Properties

Compound NameN-(3-quinolin-7-yloxypropyl)aniline
PubChem CID107315213
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-(3-quinolin-7-yloxypropyl)aniline
SMILESc1ccc(NCCCOc2ccc3cccnc3c2)cc1
InChIInChI=1S/C18H18N2O/c1-2-7-16(8-3-1)19-12-5-13-21-17-10-9-15-6-4-11-20-18(15)14-17/h1-4,6-11,14,19H,5,12-13H2
InChIKeyUCQNQGATWLOYOS-UHFFFAOYSA-N
XLogP4.12
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-bromo-N-(2-quinolin-7-yloxyethyl)aniline
CID 107315214
N-ethyl-2-quinolin-7-yloxyethanamine
CID 107313475
3-quinolin-7-yloxypropane-1-thiol
CID 107315768
6-quinolin-7-yloxyhexan-1-ol
CID 107705479
N-(2-quinolin-7-yloxyethyl)cyclohexanamine
CID 107315321
N',N'-dimethyl-N-(2-quinolin-7-yloxyethyl)ethane-1,2-diamine
CID 107315215
N-(4-quinolin-7-yloxybutyl)cyclopropanamine
CID 107314991
N-propan-2-yl-5-quinolin-7-yloxypentan-1-amine
CID 107314998
3-quinolin-7-yloxypropanal
CID 107314214
7-(3-azidopropoxy)quinoline
CID 107314475
4-methoxy-N-[3-[6-[3-(4-methoxyanilino)propoxy]naphthalen-2-yl]oxypropyl]aniline
CID 10096933
N-ethyl-6-quinolin-7-yloxyhexan-3-amine
CID 107313514

Frequently Asked Questions

What is the IUPAC name of N-(3-quinolin-7-yloxypropyl)aniline?
The IUPAC name of N-(3-quinolin-7-yloxypropyl)aniline (CID 107315213) is N-(3-quinolin-7-yloxypropyl)aniline.
What is the SMILES notation for N-(3-quinolin-7-yloxypropyl)aniline?
The canonical SMILES for N-(3-quinolin-7-yloxypropyl)aniline is c1ccc(NCCCOc2ccc3cccnc3c2)cc1.
What is the InChIKey of N-(3-quinolin-7-yloxypropyl)aniline?
The InChIKey is UCQNQGATWLOYOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-7-16(8-3-1)19-12-5-13-21-17-10-9-15-6-4-11-20-18(15)14-17/h1-4,6-11,14,19H,5,12-13H2.
What are the key properties of N-(3-quinolin-7-yloxypropyl)aniline?
N-(3-quinolin-7-yloxypropyl)aniline has a molecular weight of 278.36 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-quinolin-7-yloxypropyl)aniline is sourced from PubChem (CID 107315213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).