1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile

C17H19N3O — CID 79576657

IUPAC1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile
SMILESN#CC1(N)CCCC1CCOc1cccc2cccnc12
InChIInChI=1S/C17H19N3O/c18-12-17(19)9-2-6-14(17)8-11-21-15-7-1-4-13-5-3-10-20-16(13)15/h1,3-5,7,10,14H,2,6,8-9,11,19H2
InChIKeyIMQDVPKCKPIVQR-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.02
Rot. Bonds4

About 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile

1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile (PubChem CID 79576657) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile
PubChem CID79576657
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile
SMILESN#CC1(N)CCCC1CCOc1cccc2cccnc12
InChIInChI=1S/C17H19N3O/c18-12-17(19)9-2-6-14(17)8-11-21-15-7-1-4-13-5-3-10-20-16(13)15/h1,3-5,7,10,14H,2,6,8-9,11,19H2
InChIKeyIMQDVPKCKPIVQR-UHFFFAOYSA-N
XLogP3.02
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-2-[2-(2-methoxy-4-methylphenoxy)ethyl]cyclopentane-1-carbonitrile
CID 79576804
2-quinolin-8-yloxyethanamine
CID 17174906
N-(2-quinolin-8-yloxyethyl)cyclopentanamine
CID 62599062
(1-amino-3-quinolin-8-yloxycyclohexyl)methanol
CID 79640420
2-quinolin-8-yloxyethylhydrazine
CID 82126133
[1-(quinolin-8-yloxymethyl)cyclopropyl]methanamine
CID 117051439
1-amino-2-[2-(1,3-dihydroisoindol-2-yl)ethyl]cyclopentane-1-carbonitrile
CID 79573697
[1-(quinolin-8-yloxymethyl)cyclohexyl]methanamine
CID 94696957
8-(6-chlorohexoxy)quinoline
CID 62228191
8-[2-(4-bromophenoxy)ethoxy]quinoline
CID 2289161
8-[2-(4-methylpiperazin-1-yl)ethoxy]quinoline
CID 24849053
8-(chloromethoxy)quinoline
CID 79531226

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile?
The IUPAC name of 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile (CID 79576657) is 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile?
The canonical SMILES for 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile is N#CC1(N)CCCC1CCOc1cccc2cccnc12.
What is the InChIKey of 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile?
The InChIKey is IMQDVPKCKPIVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c18-12-17(19)9-2-6-14(17)8-11-21-15-7-1-4-13-5-3-10-20-16(13)15/h1,3-5,7,10,14H,2,6,8-9,11,19H2.
What are the key properties of 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile?
1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile has a molecular weight of 281.36 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(2-quinolin-8-yloxyethyl)cyclopentane-1-carbonitrile is sourced from PubChem (CID 79576657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).