2-methyl-5-(quinolin-8-ylamino)pentan-2-ol

C15H20N2O — CID 118731137

IUPAC2-methyl-5-(quinolin-8-ylamino)pentan-2-ol
SMILESCC(C)(O)CCCNc1cccc2cccnc12
InChIInChI=1S/C15H20N2O/c1-15(2,18)9-5-11-16-13-8-3-6-12-7-4-10-17-14(12)13/h3-4,6-8,10,16,18H,5,9,11H2,1-2H3
InChIKeyXRJCTZRIHQKTCC-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.20
Rot. Bonds5

About 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol

2-methyl-5-(quinolin-8-ylamino)pentan-2-ol (PubChem CID 118731137) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol.

Molecular Properties

Compound Name2-methyl-5-(quinolin-8-ylamino)pentan-2-ol
PubChem CID118731137
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-methyl-5-(quinolin-8-ylamino)pentan-2-ol
SMILESCC(C)(O)CCCNc1cccc2cccnc12
InChIInChI=1S/C15H20N2O/c1-15(2,18)9-5-11-16-13-8-3-6-12-7-4-10-17-14(12)13/h3-4,6-8,10,16,18H,5,9,11H2,1-2H3
InChIKeyXRJCTZRIHQKTCC-UHFFFAOYSA-N
XLogP3.20
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.20
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-(3,3-dimethylbutyl)quinolin-8-amine
CID 62965994
N-heptylquinolin-8-amine
CID 43130175
N-(3-methoxy-3-methylbutyl)quinolin-8-amine
CID 106675039
5-(quinolin-8-ylamino)pentylcarbamic acid
CID 126720717
4-[(5-chloroquinolin-8-yl)amino]-2-methylbutan-2-ol
CID 116783853
N-quinolin-8-ylhydroxylamine
CID 22011433
N-[(2-methylpyrimidin-4-yl)methyl]quinolin-8-amine
CID 62749451
2-[1-[3-(quinolin-8-ylamino)propyl]triazol-4-yl]ethanol
CID 162640094
5-(butylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109180980
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]quinolin-8-amine
CID 82538975
N-(2,6-diethylphenyl)-2-(quinolin-8-ylamino)acetamide
CID 109008069
5-methyl-2-quinolin-8-ylhexan-2-ol
CID 114280033

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol?
The IUPAC name of 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol (CID 118731137) is 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol.
What is the SMILES notation for 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol?
The canonical SMILES for 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol is CC(C)(O)CCCNc1cccc2cccnc12.
What is the InChIKey of 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol?
The InChIKey is XRJCTZRIHQKTCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-15(2,18)9-5-11-16-13-8-3-6-12-7-4-10-17-14(12)13/h3-4,6-8,10,16,18H,5,9,11H2,1-2H3.
What are the key properties of 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol?
2-methyl-5-(quinolin-8-ylamino)pentan-2-ol has a molecular weight of 244.34 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(quinolin-8-ylamino)pentan-2-ol is sourced from PubChem (CID 118731137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).