N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide

C10H12F2N2O2 — CID 114383539

IUPACN-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide
SMILESNCC(F)(F)CNC(=O)c1cccc(O)c1
InChIInChI=1S/C10H12F2N2O2/c11-10(12,5-13)6-14-9(16)7-2-1-3-8(15)4-7/h1-4,15H,5-6,13H2,(H,14,16)
InChIKeyNOKNSCPOHXGWIJ-UHFFFAOYSA-N
MW230.21 g/mol
LogP0.72
Rot. Bonds4

About N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide

N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide (PubChem CID 114383539) has the molecular formula C10H12F2N2O2 and a molecular weight of 230.21 g/mol. Its IUPAC name is N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide
PubChem CID114383539
Molecular FormulaC10H12F2N2O2
Molecular Weight230.21 g/mol
Exact Mass230.09
IUPAC NameN-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide
SMILESNCC(F)(F)CNC(=O)c1cccc(O)c1
InChIInChI=1S/C10H12F2N2O2/c11-10(12,5-13)6-14-9(16)7-2-1-3-8(15)4-7/h1-4,15H,5-6,13H2,(H,14,16)
InChIKeyNOKNSCPOHXGWIJ-UHFFFAOYSA-N
XLogP0.72
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.21
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2,2-difluoropropyl)-3-chlorobenzamide
CID 114383601
N-(3-amino-2,2-difluoropropyl)-3-(difluoromethoxy)benzamide
CID 114383418
N-(3-amino-2,2-difluoropropyl)-2,3-dihydroxybenzamide
CID 114383835
N-(3-chloro-2,2-dimethylpropyl)-3-hydroxybenzamide
CID 115364515
3-hydroxy-N-(3-hydroxy-2,2-dimethylpropyl)benzamide
CID 110465856
N-(3-amino-2,2-difluoropropyl)thiophene-3-carboxamide
CID 114383347
N-(3-amino-2,2-difluoropropyl)-3-hydroxy-4-methoxybenzamide
CID 114383634
N-(3-amino-2,2-difluoropropyl)-2-hydroxybenzamide
CID 114383534
N-(3-amino-2,2-difluoropropyl)-4-chlorobenzamide
CID 114383666
N-ethyl-3-hydroxybenzamide
CID 13175248
N-[2-(carbamoylamino)ethyl]-3-hydroxybenzamide
CID 83120683
methyl 2-[(3-hydroxybenzoyl)amino]acetate
CID 578046

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide?
The IUPAC name of N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide (CID 114383539) is N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide.
What is the SMILES notation for N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide?
The canonical SMILES for N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide is NCC(F)(F)CNC(=O)c1cccc(O)c1.
What is the InChIKey of N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide?
The InChIKey is NOKNSCPOHXGWIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O2/c11-10(12,5-13)6-14-9(16)7-2-1-3-8(15)4-7/h1-4,15H,5-6,13H2,(H,14,16).
What are the key properties of N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide?
N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide has a molecular weight of 230.21 g/mol, XLogP of 0.72, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-difluoropropyl)-3-hydroxybenzamide is sourced from PubChem (CID 114383539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).