3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol

C7H14FNO — CID 130874629

IUPAC3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol
SMILESCC1(C(O)CCN)CC1F
InChIInChI=1S/C7H14FNO/c1-7(4-5(7)8)6(10)2-3-9/h5-6,10H,2-4,9H2,1H3
InChIKeyBJUZHVJKWKYWGZ-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.44
Rot. Bonds3

About 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol

3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol (PubChem CID 130874629) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol.

Molecular Properties

Compound Name3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol
PubChem CID130874629
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol
SMILESCC1(C(O)CCN)CC1F
InChIInChI=1S/C7H14FNO/c1-7(4-5(7)8)6(10)2-3-9/h5-6,10H,2-4,9H2,1H3
InChIKeyBJUZHVJKWKYWGZ-UHFFFAOYSA-N
XLogP0.44
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol?
The IUPAC name of 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol (CID 130874629) is 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol.
What is the SMILES notation for 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol?
The canonical SMILES for 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol is CC1(C(O)CCN)CC1F.
What is the InChIKey of 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol?
The InChIKey is BJUZHVJKWKYWGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-7(4-5(7)8)6(10)2-3-9/h5-6,10H,2-4,9H2,1H3.
What are the key properties of 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol?
3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol has a molecular weight of 147.19 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-fluoro-1-methylcyclopropyl)propan-1-ol is sourced from PubChem (CID 130874629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).