4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol

C10H12FNO — CID 55254203

IUPAC4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol
SMILESN[C@@H](c1ccc(O)c(F)c1)C1CC1
InChIInChI=1S/C10H12FNO/c11-8-5-7(3-4-9(8)13)10(12)6-1-2-6/h3-6,10,13H,1-2,12H2/t10-/m1/s1
InChIKeyZOUHBCAOLZCMLH-SNVBAGLBSA-N
MW181.21 g/mol
LogP1.94
Rot. Bonds2

About 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol

4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol (PubChem CID 55254203) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol.

Molecular Properties

Compound Name4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol
PubChem CID55254203
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol
SMILESN[C@@H](c1ccc(O)c(F)c1)C1CC1
InChIInChI=1S/C10H12FNO/c11-8-5-7(3-4-9(8)13)10(12)6-1-2-6/h3-6,10,13H,1-2,12H2/t10-/m1/s1
InChIKeyZOUHBCAOLZCMLH-SNVBAGLBSA-N
XLogP1.94
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-cyclopropyl-(3,4-difluorophenyl)methanamine;hydrochloride
CID 171229648
4-[(R)-amino(cyclopropyl)methyl]benzene-1,2-diol;hydrochloride
CID 171198097
4-[(R)-amino(cyclopentyl)methyl]benzene-1,2-diol
CID 131343814
(R)-(3-bromo-4-fluorophenyl)-cyclopropylmethanamine
CID 130739408
4-(1-amino-2,2-difluoroethyl)-2-fluorophenol
CID 130062652
(3,4-difluorophenyl)-piperidin-4-ylmethanamine
CID 82287810
4-[(S)-amino(cyclopropyl)methyl]-2-nitrophenol;hydrochloride
CID 171219479
4-[(R)-amino(cyclopropyl)methyl]-2-ethoxyphenol
CID 171200844
4-[(R)-amino(cyclopentyl)methyl]-2-methylphenol;hydrochloride
CID 171213118
(R)-(4-bromo-3-fluorophenyl)-cyclopentylmethanamine;hydrochloride
CID 171201791
5-[(R)-amino(cyclopropyl)methyl]-2-methoxyphenol
CID 55254634
(R)-(4-chloro-3-fluorophenyl)-cyclobutylmethanamine;hydrochloride
CID 171209453

Frequently Asked Questions

What is the IUPAC name of 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol?
The IUPAC name of 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol (CID 55254203) is 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol.
What is the SMILES notation for 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol?
The canonical SMILES for 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol is N[C@@H](c1ccc(O)c(F)c1)C1CC1.
What is the InChIKey of 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol?
The InChIKey is ZOUHBCAOLZCMLH-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H12FNO/c11-8-5-7(3-4-9(8)13)10(12)6-1-2-6/h3-6,10,13H,1-2,12H2/t10-/m1/s1.
What are the key properties of 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol?
4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol has a molecular weight of 181.21 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(R)-amino(cyclopropyl)methyl]-2-fluorophenol is sourced from PubChem (CID 55254203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).