2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine

C14H20N4 — CID 113284087

IUPAC2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine
SMILESCC(C)C(C)(CN)Nc1cnc2ccccc2n1
InChIInChI=1S/C14H20N4/c1-10(2)14(3,9-15)18-13-8-16-11-6-4-5-7-12(11)17-13/h4-8,10H,9,15H2,1-3H3,(H,17,18)
InChIKeyHOKVKDNVLOFAJH-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.42
Rot. Bonds4

About 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine

2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine (PubChem CID 113284087) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine.

Molecular Properties

Compound Name2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine
PubChem CID113284087
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine
SMILESCC(C)C(C)(CN)Nc1cnc2ccccc2n1
InChIInChI=1S/C14H20N4/c1-10(2)14(3,9-15)18-13-8-16-11-6-4-5-7-12(11)17-13/h4-8,10H,9,15H2,1-3H3,(H,17,18)
InChIKeyHOKVKDNVLOFAJH-UHFFFAOYSA-N
XLogP2.42
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylbutan-2-yl)quinoxalin-2-amine
CID 22341074
(2R)-2,3-dimethyl-1-(quinoxalin-2-ylamino)butan-2-ol
CID 95624706
2-methyl-2-(quinoxalin-2-ylamino)propanamide
CID 62360239
N-(2-phenylpropyl)quinoxalin-2-amine
CID 47142875
1-N-quinoxalin-2-ylbutane-1,2-diamine;dihydrochloride
CID 141390759
4-methyl-3-(quinoxalin-2-ylamino)pentan-1-ol
CID 113242419
N-(4-chloro-2-methylbutyl)quinoxalin-2-amine
CID 66089943
N-[(1-propan-2-ylcyclopropyl)methyl]quinoxalin-2-amine
CID 114114989
3-N-quinoxalin-2-ylpentane-1,3-diamine
CID 113496622
quinoxalin-2-ylhydrazine;hydrochloride
CID 18995251
N-(1-chloro-4,4-dimethylpentan-3-yl)quinoxalin-2-amine
CID 106354521
N-tert-butyl-2-(quinoxalin-2-ylamino)propanamide
CID 115596829

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine?
The IUPAC name of 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine (CID 113284087) is 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine.
What is the SMILES notation for 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine?
The canonical SMILES for 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine is CC(C)C(C)(CN)Nc1cnc2ccccc2n1.
What is the InChIKey of 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine?
The InChIKey is HOKVKDNVLOFAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-10(2)14(3,9-15)18-13-8-16-11-6-4-5-7-12(11)17-13/h4-8,10H,9,15H2,1-3H3,(H,17,18).
What are the key properties of 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine?
2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine has a molecular weight of 244.34 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-2-N-quinoxalin-2-ylbutane-1,2-diamine is sourced from PubChem (CID 113284087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).