N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine

C14H15F2N3 — CID 133309923

IUPACN-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine
SMILESCCN(CC1CC1)c1cnc2cc(F)c(F)cc2n1
InChIInChI=1S/C14H15F2N3/c1-2-19(8-9-3-4-9)14-7-17-12-5-10(15)11(16)6-13(12)18-14/h5-7,9H,2-4,8H2,1H3
InChIKeySJNPJXXYGAGCAH-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.14
Rot. Bonds4

About N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine

N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine (PubChem CID 133309923) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine
PubChem CID133309923
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine
SMILESCCN(CC1CC1)c1cnc2cc(F)c(F)cc2n1
InChIInChI=1S/C14H15F2N3/c1-2-19(8-9-3-4-9)14-7-17-12-5-10(15)11(16)6-13(12)18-14/h5-7,9H,2-4,8H2,1H3
InChIKeySJNPJXXYGAGCAH-UHFFFAOYSA-N
XLogP3.14
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine (CID 133309923) is N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine is CCN(CC1CC1)c1cnc2cc(F)c(F)cc2n1.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine?
The InChIKey is SJNPJXXYGAGCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c1-2-19(8-9-3-4-9)14-7-17-12-5-10(15)11(16)6-13(12)18-14/h5-7,9H,2-4,8H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine?
N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine has a molecular weight of 263.29 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-6,7-difluoroquinoxalin-2-amine is sourced from PubChem (CID 133309923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).