N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine

C11H11F2N3 — CID 102869134

IUPACN-(1,1-difluoropropan-2-yl)quinoxalin-6-amine
SMILESCC(Nc1ccc2nccnc2c1)C(F)F
InChIInChI=1S/C11H11F2N3/c1-7(11(12)13)16-8-2-3-9-10(6-8)15-5-4-14-9/h2-7,11,16H,1H3
InChIKeySGMIGNDWRLMVPE-UHFFFAOYSA-N
MW223.23 g/mol
LogP2.70
Rot. Bonds3

About N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine

N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine (PubChem CID 102869134) has the molecular formula C11H11F2N3 and a molecular weight of 223.23 g/mol. Its IUPAC name is N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine.

Molecular Properties

Compound NameN-(1,1-difluoropropan-2-yl)quinoxalin-6-amine
PubChem CID102869134
Molecular FormulaC11H11F2N3
Molecular Weight223.23 g/mol
Exact Mass223.09
IUPAC NameN-(1,1-difluoropropan-2-yl)quinoxalin-6-amine
SMILESCC(Nc1ccc2nccnc2c1)C(F)F
InChIInChI=1S/C11H11F2N3/c1-7(11(12)13)16-8-2-3-9-10(6-8)15-5-4-14-9/h2-7,11,16H,1H3
InChIKeySGMIGNDWRLMVPE-UHFFFAOYSA-N
XLogP2.70
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpentan-2-yl)quinoxalin-6-amine
CID 54863402
N-[1-(2-fluorophenyl)ethyl]quinoxalin-6-amine
CID 60943140
N-heptan-2-ylquinoxalin-6-amine
CID 54863501
N-(1,1-difluoropropan-2-yl)-3-fluoro-4-methylaniline
CID 102867861
4-methyl-2-[1-(quinoxalin-6-ylamino)ethyl]phenol
CID 60944016
N-(1,1-difluoropropan-2-yl)-4-iodoaniline
CID 102868199
4-chloro-N-(1,1-difluoropropan-2-yl)aniline
CID 102867820
2-chloro-N-quinoxalin-6-ylpropanamide
CID 60933766
N'-methyl-N'-propan-2-yl-N-quinoxalin-6-yloxamide
CID 99716975
3-bromo-N-(1,1-difluoropropan-2-yl)aniline
CID 102867830
N-[[4-(difluoromethyl)phenyl]methyl]quinoxalin-6-amine
CID 115523823
N-prop-2-ynylquinoxalin-6-amine
CID 63953900

Frequently Asked Questions

What is the IUPAC name of N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine?
The IUPAC name of N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine (CID 102869134) is N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine.
What is the SMILES notation for N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine?
The canonical SMILES for N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine is CC(Nc1ccc2nccnc2c1)C(F)F.
What is the InChIKey of N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine?
The InChIKey is SGMIGNDWRLMVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N3/c1-7(11(12)13)16-8-2-3-9-10(6-8)15-5-4-14-9/h2-7,11,16H,1H3.
What are the key properties of N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine?
N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine has a molecular weight of 223.23 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine is sourced from PubChem (CID 102869134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).