N-(4-methylpentan-2-yl)quinoxalin-6-amine

C14H19N3 — CID 54863402

IUPACN-(4-methylpentan-2-yl)quinoxalin-6-amine
SMILESCC(C)CC(C)Nc1ccc2nccnc2c1
InChIInChI=1S/C14H19N3/c1-10(2)8-11(3)17-12-4-5-13-14(9-12)16-7-6-15-13/h4-7,9-11,17H,8H2,1-3H3
InChIKeySHKHOWDERQBYEQ-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.48
Rot. Bonds4

About N-(4-methylpentan-2-yl)quinoxalin-6-amine

N-(4-methylpentan-2-yl)quinoxalin-6-amine (PubChem CID 54863402) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N-(4-methylpentan-2-yl)quinoxalin-6-amine.

Molecular Properties

Compound NameN-(4-methylpentan-2-yl)quinoxalin-6-amine
PubChem CID54863402
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN-(4-methylpentan-2-yl)quinoxalin-6-amine
SMILESCC(C)CC(C)Nc1ccc2nccnc2c1
InChIInChI=1S/C14H19N3/c1-10(2)8-11(3)17-12-4-5-13-14(9-12)16-7-6-15-13/h4-7,9-11,17H,8H2,1-3H3
InChIKeySHKHOWDERQBYEQ-UHFFFAOYSA-N
XLogP3.48
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-heptan-2-ylquinoxalin-6-amine
CID 54863501
N-(1,1-difluoropropan-2-yl)quinoxalin-6-amine
CID 102869134
2-chloro-N-(4-methylpentan-2-yl)pyridin-4-amine
CID 115486493
(2S)-2-amino-4-methyl-N-quinoxalin-6-ylpentanamide
CID 61179769
4-N-(4-methylpentan-2-yl)benzene-1,2,4-triamine
CID 106750392
4-N-(4-methylpentan-2-yl)-1-N-[4-(4-methylpentan-2-ylamino)phenyl]benzene-1,4-diamine
CID 10981440
6-chloro-N-[(2S)-4-methylpentan-2-yl]pyridin-3-amine
CID 97358406
N-[1-(2-fluorophenyl)ethyl]quinoxalin-6-amine
CID 60943140
3-fluoro-4-methyl-N-(4-methylpentan-2-yl)aniline
CID 43098407
3-methyl-4-[2-[2-methyl-4-(4-methylpentan-2-ylamino)phenoxy]ethoxy]-N-(4-methylpentan-2-yl)aniline
CID 70605236
4-[(E)-but-1-enyl]-1-N-(4-methylpentan-2-yl)benzene-1,3-diamine
CID 68638074
3-chloro-4-fluoro-N-(4-methylpentan-2-yl)aniline
CID 43119238

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpentan-2-yl)quinoxalin-6-amine?
The IUPAC name of N-(4-methylpentan-2-yl)quinoxalin-6-amine (CID 54863402) is N-(4-methylpentan-2-yl)quinoxalin-6-amine.
What is the SMILES notation for N-(4-methylpentan-2-yl)quinoxalin-6-amine?
The canonical SMILES for N-(4-methylpentan-2-yl)quinoxalin-6-amine is CC(C)CC(C)Nc1ccc2nccnc2c1.
What is the InChIKey of N-(4-methylpentan-2-yl)quinoxalin-6-amine?
The InChIKey is SHKHOWDERQBYEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10(2)8-11(3)17-12-4-5-13-14(9-12)16-7-6-15-13/h4-7,9-11,17H,8H2,1-3H3.
What are the key properties of N-(4-methylpentan-2-yl)quinoxalin-6-amine?
N-(4-methylpentan-2-yl)quinoxalin-6-amine has a molecular weight of 229.33 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpentan-2-yl)quinoxalin-6-amine is sourced from PubChem (CID 54863402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).