4-(2-fluoroanilino)pentan-1-ol

C11H16FNO — CID 115975993

IUPAC4-(2-fluoroanilino)pentan-1-ol
SMILESCC(CCCO)Nc1ccccc1F
InChIInChI=1S/C11H16FNO/c1-9(5-4-8-14)13-11-7-3-2-6-10(11)12/h2-3,6-7,9,13-14H,4-5,8H2,1H3
InChIKeyMZPCOOFDAVYAOG-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.40
Rot. Bonds5

About 4-(2-fluoroanilino)pentan-1-ol

4-(2-fluoroanilino)pentan-1-ol (PubChem CID 115975993) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 4-(2-fluoroanilino)pentan-1-ol.

Molecular Properties

Compound Name4-(2-fluoroanilino)pentan-1-ol
PubChem CID115975993
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name4-(2-fluoroanilino)pentan-1-ol
SMILESCC(CCCO)Nc1ccccc1F
InChIInChI=1S/C11H16FNO/c1-9(5-4-8-14)13-11-7-3-2-6-10(11)12/h2-3,6-7,9,13-14H,4-5,8H2,1H3
InChIKeyMZPCOOFDAVYAOG-UHFFFAOYSA-N
XLogP2.40
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(2-fluoroanilino)pentan-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

4-(2-fluoro-3-methylanilino)pentan-1-ol
CID 115976062
4-(2-fluoro-5-methylanilino)pentan-1-ol
CID 115976054
4-[2-fluoro-4-(trifluoromethyl)anilino]pentan-1-ol
CID 113254397
4-(3-bromo-2-methylanilino)pentan-1-ol
CID 115976130
2-(2-fluoroanilino)-3-methylbutan-1-ol
CID 61317704
N-(1-ethylsulfonylpropan-2-yl)-2-fluoroaniline
CID 115921635
2-(5-hydroxypentan-2-ylamino)-6-methylsulfanylbenzonitrile
CID 113385604
2-fluoro-6-(4-hydroxybutan-2-ylamino)benzonitrile
CID 78997304
2-fluoro-N-[(3R)-2-methylpentan-3-yl]aniline
CID 93283017
3-(3-fluoro-2-nitroanilino)butan-1-ol
CID 79003358
4-(4-chloro-2-methylanilino)pentan-1-ol
CID 115976044
2-fluoro-6-(heptan-2-ylamino)benzoic acid
CID 79522598

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroanilino)pentan-1-ol?
The IUPAC name of 4-(2-fluoroanilino)pentan-1-ol (CID 115975993) is 4-(2-fluoroanilino)pentan-1-ol.
What is the SMILES notation for 4-(2-fluoroanilino)pentan-1-ol?
The canonical SMILES for 4-(2-fluoroanilino)pentan-1-ol is CC(CCCO)Nc1ccccc1F.
What is the InChIKey of 4-(2-fluoroanilino)pentan-1-ol?
The InChIKey is MZPCOOFDAVYAOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-9(5-4-8-14)13-11-7-3-2-6-10(11)12/h2-3,6-7,9,13-14H,4-5,8H2,1H3.
What are the key properties of 4-(2-fluoroanilino)pentan-1-ol?
4-(2-fluoroanilino)pentan-1-ol has a molecular weight of 197.25 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroanilino)pentan-1-ol is sourced from PubChem (CID 115975993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).