3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine

C17H24N4 — CID 62993510

IUPAC3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NCC(C)CN1CCCC1
InChIInChI=1S/C17H24N4/c1-13(12-21-9-5-6-10-21)11-18-17-14(2)19-15-7-3-4-8-16(15)20-17/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,18,20)
InChIKeyXIHVEOFXKZWSOO-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.08
Rot. Bonds5

About 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine

3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine (PubChem CID 62993510) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine
PubChem CID62993510
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NCC(C)CN1CCCC1
InChIInChI=1S/C17H24N4/c1-13(12-21-9-5-6-10-21)11-18-17-14(2)19-15-7-3-4-8-16(15)20-17/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,18,20)
InChIKeyXIHVEOFXKZWSOO-UHFFFAOYSA-N
XLogP3.08
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-benzotriazin-3-amine
CID 103204138
N-(3-methoxy-2-methylpropyl)-3-methylquinoxalin-2-amine
CID 47430216
N-(2-methyl-3-pyrrolidin-1-ylpropyl)phthalazin-1-amine
CID 60966697
3-methyl-N-(3-methyl-2-propan-2-ylbutyl)quinoxalin-2-amine
CID 102913999
3-methyl-N-[2-(4-methylpiperazin-1-yl)propyl]quinoxalin-2-amine
CID 133301516
N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-benzothiazol-2-amine
CID 47283339
4-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)phthalazin-1-amine
CID 62994226
3-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)quinoxalin-2-amine
CID 42892067
6-hydrazinyl-2,5-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 80914851
3-methyl-N-(2-methylsulfinylpropyl)quinoxalin-2-amine
CID 115764306
6-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyridine-2,6-diamine
CID 80647967
3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]quinoxalin-2-amine
CID 60734250

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine?
The IUPAC name of 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine (CID 62993510) is 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine.
What is the SMILES notation for 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine?
The canonical SMILES for 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine is Cc1nc2ccccc2nc1NCC(C)CN1CCCC1.
What is the InChIKey of 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine?
The InChIKey is XIHVEOFXKZWSOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-13(12-21-9-5-6-10-21)11-18-17-14(2)19-15-7-3-4-8-16(15)20-17/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,18,20).
What are the key properties of 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine?
3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine has a molecular weight of 284.41 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine is sourced from PubChem (CID 62993510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).