N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide

C15H22N2O2 — CID 106901745

IUPACN-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
SMILESCCC(O)CCNC(=O)C1CNc2ccccc2C1
InChIInChI=1S/C15H22N2O2/c1-2-13(18)7-8-16-15(19)12-9-11-5-3-4-6-14(11)17-10-12/h3-6,12-13,17-18H,2,7-10H2,1H3,(H,16,19)
InChIKeySGRAQTKECGJOMM-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.55
Rot. Bonds5

About N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide

N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide (PubChem CID 106901745) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
PubChem CID106901745
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
SMILESCCC(O)CCNC(=O)C1CNc2ccccc2C1
InChIInChI=1S/C15H22N2O2/c1-2-13(18)7-8-16-15(19)12-9-11-5-3-4-6-14(11)17-10-12/h3-6,12-13,17-18H,2,7-10H2,1H3,(H,16,19)
InChIKeySGRAQTKECGJOMM-UHFFFAOYSA-N
XLogP1.55
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901213
N-pent-3-ynyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901779
N-(5,5,5-trifluoropentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 115519993
N-(2-cyclobutylethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901730
N-hex-5-yn-3-yl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901728
N-[(2S)-1-hydroxypropan-2-yl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 107219186
N-[(4-hydroxycyclohexyl)methyl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106135423
N-[(4-methylthiophen-3-yl)methyl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901620
N-(thiophen-3-ylmethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901469
N-(1-thiophen-2-ylethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901236
N-(2H-tetrazol-5-ylmethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901428
N-(4-hydroxy-1-methoxybutan-2-yl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106160965

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The IUPAC name of N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide (CID 106901745) is N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide.
What is the SMILES notation for N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The canonical SMILES for N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide is CCC(O)CCNC(=O)C1CNc2ccccc2C1.
What is the InChIKey of N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The InChIKey is SGRAQTKECGJOMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-13(18)7-8-16-15(19)12-9-11-5-3-4-6-14(11)17-10-12/h3-6,12-13,17-18H,2,7-10H2,1H3,(H,16,19).
What are the key properties of N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.55, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide is sourced from PubChem (CID 106901745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).