3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol

C15H22FNO — CID 55099405

IUPAC3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol
SMILESCCCN(CCC(O)c1ccccc1F)C1CC1
InChIInChI=1S/C15H22FNO/c1-2-10-17(12-7-8-12)11-9-15(18)13-5-3-4-6-14(13)16/h3-6,12,15,18H,2,7-11H2,1H3
InChIKeyUSZUCCKHDKDZSL-UHFFFAOYSA-N
MW251.34 g/mol
LogP3.12
Rot. Bonds7

About 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol

3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol (PubChem CID 55099405) has the molecular formula C15H22FNO and a molecular weight of 251.34 g/mol. Its IUPAC name is 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol.

Molecular Properties

Compound Name3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol
PubChem CID55099405
Molecular FormulaC15H22FNO
Molecular Weight251.34 g/mol
Exact Mass251.17
IUPAC Name3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol
SMILESCCCN(CCC(O)c1ccccc1F)C1CC1
InChIInChI=1S/C15H22FNO/c1-2-10-17(12-7-8-12)11-9-15(18)13-5-3-4-6-14(13)16/h3-6,12,15,18H,2,7-11H2,1H3
InChIKeyUSZUCCKHDKDZSL-UHFFFAOYSA-N
XLogP3.12
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-butyl-N'-cyclopropyl-1-(2-fluorophenyl)propane-1,3-diamine
CID 62645216
3-(diethylamino)-1-(2-fluorophenyl)propan-1-ol
CID 62643876
3-(dimethylamino)-1-(2-fluorophenyl)propan-1-ol
CID 62645456
3-[cyclopropyl(2-hydroxyethyl)amino]-1-(2-methylphenyl)propan-1-ol
CID 62624580
1-(2-fluorophenyl)-3-[2-hydroxypropyl(methyl)amino]propan-1-ol
CID 62630697
N'-cyclopropyl-N'-ethyl-1-(2-fluorophenyl)-N-methylpropane-1,3-diamine
CID 55099247
N'-cyclopropyl-1-(2-fluorophenyl)-N,2-dimethyl-N'-propylpropane-1,3-diamine
CID 115996737
3-[ethyl(propan-2-yl)amino]-1-(2-fluorophenyl)propan-1-ol
CID 62629969
N'-cyclopropyl-1-(2-methylphenyl)-N'-propylpropane-1,3-diamine
CID 55098071
1-(2-fluorophenyl)-3-[methyl-(1-methylpiperidin-3-yl)amino]propan-1-ol
CID 62631209
3-(2-fluoro-N-methylanilino)-1-(2-fluorophenyl)propan-1-ol
CID 62629313
3-[cyclopropyl(ethyl)amino]-1-(2-fluorophenyl)-2-methylpropan-1-ol
CID 112679918

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol?
The IUPAC name of 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol (CID 55099405) is 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol.
What is the SMILES notation for 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol?
The canonical SMILES for 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol is CCCN(CCC(O)c1ccccc1F)C1CC1.
What is the InChIKey of 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol?
The InChIKey is USZUCCKHDKDZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO/c1-2-10-17(12-7-8-12)11-9-15(18)13-5-3-4-6-14(13)16/h3-6,12,15,18H,2,7-11H2,1H3.
What are the key properties of 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol?
3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol has a molecular weight of 251.34 g/mol, XLogP of 3.12, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropyl(propyl)amino]-1-(2-fluorophenyl)propan-1-ol is sourced from PubChem (CID 55099405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).