N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide

C17H26N2O2 — CID 43117557

IUPACN-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
SMILESCCCCCNC(=O)C(C)Oc1cccc2c1NCCC2
InChIInChI=1S/C17H26N2O2/c1-3-4-5-11-19-17(20)13(2)21-15-10-6-8-14-9-7-12-18-16(14)15/h6,8,10,13,18H,3-5,7,9,11-12H2,1-2H3,(H,19,20)
InChIKeySAASKCSHKRWTJY-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.12
Rot. Bonds7

About N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide

N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide (PubChem CID 43117557) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide.

Molecular Properties

Compound NameN-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
PubChem CID43117557
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
SMILESCCCCCNC(=O)C(C)Oc1cccc2c1NCCC2
InChIInChI=1S/C17H26N2O2/c1-3-4-5-11-19-17(20)13(2)21-15-10-6-8-14-9-7-12-18-16(14)15/h6,8,10,13,18H,3-5,7,9,11-12H2,1-2H3,(H,19,20)
InChIKeySAASKCSHKRWTJY-UHFFFAOYSA-N
XLogP3.12
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
CID 43117550
N-propan-2-yl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
CID 43117555
N-butyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62213109
2-[2-[1-oxo-1-(pentylamino)propan-2-yl]oxyphenyl]acetic acid
CID 80722346
2-[1-oxo-1-(pentylamino)propan-2-yl]oxybenzoic acid
CID 43113670
(2R)-N-pentyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100553248
N-pentan-2-yl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)acetamide
CID 61026655
N-butyl-2-[(5-oxo-7,8-dihydro-6H-naphthalen-1-yl)oxy]propanamide
CID 65454063
(2R)-N-butyl-2-(2-methoxyphenoxy)propanamide
CID 40745436
N-ethyl-3-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
CID 62324258
N-(3-phenylpropyl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 133261915
(2R)-N-[(2S)-2-ethylhexyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 100546024

Frequently Asked Questions

What is the IUPAC name of N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
The IUPAC name of N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide (CID 43117557) is N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide.
What is the SMILES notation for N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
The canonical SMILES for N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide is CCCCCNC(=O)C(C)Oc1cccc2c1NCCC2.
What is the InChIKey of N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
The InChIKey is SAASKCSHKRWTJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-4-5-11-19-17(20)13(2)21-15-10-6-8-14-9-7-12-18-16(14)15/h6,8,10,13,18H,3-5,7,9,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide?
N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide has a molecular weight of 290.41 g/mol, XLogP of 3.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide is sourced from PubChem (CID 43117557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).