N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine

C15H21N3 — CID 107894235

IUPACN,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine
SMILESCCCC(C)C(NC)c1cnc2ccccc2n1
InChIInChI=1S/C15H21N3/c1-4-7-11(2)15(16-3)14-10-17-12-8-5-6-9-13(12)18-14/h5-6,8-11,15-16H,4,7H2,1-3H3
InChIKeyMLLGEVWKWHASQG-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.33
Rot. Bonds5

About N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine

N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine (PubChem CID 107894235) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine
PubChem CID107894235
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine
SMILESCCCC(C)C(NC)c1cnc2ccccc2n1
InChIInChI=1S/C15H21N3/c1-4-7-11(2)15(16-3)14-10-17-12-8-5-6-9-13(12)18-14/h5-6,8-11,15-16H,4,7H2,1-3H3
InChIKeyMLLGEVWKWHASQG-UHFFFAOYSA-N
XLogP3.33
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-chloropentan-2-yl)quinoxaline
CID 174360163
(4-methyl-1-quinoxalin-2-ylpentyl)hydrazine
CID 107357839
butyl N-[(1S,2S)-2-methyl-1-quinoxalin-2-ylbutyl]carbamate
CID 101065054
1-quinoxalin-2-ylhexan-1-amine
CID 107357026
N-methyl-2-phenyl-1-quinoxalin-2-ylethanamine
CID 107356897
N-methyl-1-quinoxalin-2-ylprop-2-en-1-amine
CID 107357254
(3-ethyl-1-quinoxalin-2-ylheptyl)hydrazine
CID 107357824
N-[2-(furan-2-yl)-1-quinoxalin-2-ylethyl]propan-1-amine
CID 107357381
N,2-dimethyl-1-naphthalen-2-ylpentan-1-amine
CID 115850950
3-methyl-N-propyl-1-quinoxalin-2-ylbut-3-en-1-amine
CID 107357266
N,2-dimethyl-1-[4-(2-methylbutan-2-yl)phenyl]pentan-1-amine
CID 66258012
(4,4-dimethyl-1-quinoxalin-2-ylpentyl)hydrazine
CID 107357852

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine?
The IUPAC name of N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine (CID 107894235) is N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine.
What is the SMILES notation for N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine?
The canonical SMILES for N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine is CCCC(C)C(NC)c1cnc2ccccc2n1.
What is the InChIKey of N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine?
The InChIKey is MLLGEVWKWHASQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-4-7-11(2)15(16-3)14-10-17-12-8-5-6-9-13(12)18-14/h5-6,8-11,15-16H,4,7H2,1-3H3.
What are the key properties of N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine?
N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine has a molecular weight of 243.35 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-quinoxalin-2-ylpentan-1-amine is sourced from PubChem (CID 107894235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).