2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine

C10H14FNO — CID 112567335

IUPAC2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine
SMILESNCC(F)(Cc1ccco1)C1CC1
InChIInChI=1S/C10H14FNO/c11-10(7-12,8-3-4-8)6-9-2-1-5-13-9/h1-2,5,8H,3-4,6-7,12H2
InChIKeyDKDBJIOKAVLSRF-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.90
Rot. Bonds4

About 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine

2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine (PubChem CID 112567335) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine
PubChem CID112567335
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine
SMILESNCC(F)(Cc1ccco1)C1CC1
InChIInChI=1S/C10H14FNO/c11-10(7-12,8-3-4-8)6-9-2-1-5-13-9/h1-2,5,8H,3-4,6-7,12H2
InChIKeyDKDBJIOKAVLSRF-UHFFFAOYSA-N
XLogP1.90
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine (CID 112567335) is 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine is NCC(F)(Cc1ccco1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine?
The InChIKey is DKDBJIOKAVLSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c11-10(7-12,8-3-4-8)6-9-2-1-5-13-9/h1-2,5,8H,3-4,6-7,12H2.
What are the key properties of 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine?
2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine has a molecular weight of 183.23 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-fluoro-3-(furan-2-yl)propan-1-amine is sourced from PubChem (CID 112567335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).