2-phenyl-2-(quinolin-4-ylamino)propan-1-ol

C18H18N2O — CID 105058459

IUPAC2-phenyl-2-(quinolin-4-ylamino)propan-1-ol
SMILESCC(CO)(Nc1ccnc2ccccc12)c1ccccc1
InChIInChI=1S/C18H18N2O/c1-18(13-21,14-7-3-2-4-8-14)20-17-11-12-19-16-10-6-5-9-15(16)17/h2-12,21H,13H2,1H3,(H,19,20)
InChIKeyQSJISSDFVXMEJY-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.55
Rot. Bonds4

About 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol

2-phenyl-2-(quinolin-4-ylamino)propan-1-ol (PubChem CID 105058459) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol.

Molecular Properties

Compound Name2-phenyl-2-(quinolin-4-ylamino)propan-1-ol
PubChem CID105058459
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-phenyl-2-(quinolin-4-ylamino)propan-1-ol
SMILESCC(CO)(Nc1ccnc2ccccc12)c1ccccc1
InChIInChI=1S/C18H18N2O/c1-18(13-21,14-7-3-2-4-8-14)20-17-11-12-19-16-10-6-5-9-15(16)17/h2-12,21H,13H2,1H3,(H,19,20)
InChIKeyQSJISSDFVXMEJY-UHFFFAOYSA-N
XLogP3.55
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(isoquinolin-1-ylamino)-2-phenylpropan-1-ol
CID 105058581
N-(2-methyl-1-phenylpropan-2-yl)quinolin-4-amine
CID 70112703
2-ethyl-2-(quinolin-4-ylamino)butanoic acid
CID 79807189
N-ethylquinolin-4-amine
CID 15306588
N-tritylquinolin-5-amine
CID 95560212
2-[(3-bromo-4-methyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 106875996
N-(1-chloro-3-methylpentan-3-yl)quinolin-4-amine
CID 106167935
2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 107874941
3-hydroxy-3-phenyl-N-quinolin-5-ylbutanamide
CID 110024307
N-pentan-3-ylquinolin-4-amine
CID 61340263
N-methyl-N'-quinolin-4-ylethane-1,2-diamine
CID 62658935
2-methyl-2-(quinolin-4-ylmethylamino)propan-1-ol
CID 63868080

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol?
The IUPAC name of 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol (CID 105058459) is 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol.
What is the SMILES notation for 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol?
The canonical SMILES for 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol is CC(CO)(Nc1ccnc2ccccc12)c1ccccc1.
What is the InChIKey of 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol?
The InChIKey is QSJISSDFVXMEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-18(13-21,14-7-3-2-4-8-14)20-17-11-12-19-16-10-6-5-9-15(16)17/h2-12,21H,13H2,1H3,(H,19,20).
What are the key properties of 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol?
2-phenyl-2-(quinolin-4-ylamino)propan-1-ol has a molecular weight of 278.36 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(quinolin-4-ylamino)propan-1-ol is sourced from PubChem (CID 105058459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).