N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine

C17H24N4 — CID 103970448

IUPACN-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NCC1(CN)CCCCC1
InChIInChI=1S/C17H24N4/c1-13-16(21-15-8-4-3-7-14(15)20-13)19-12-17(11-18)9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-12,18H2,1H3,(H,19,21)
InChIKeyIATWLAFPSFSCOH-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.26
Rot. Bonds4

About N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine

N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine (PubChem CID 103970448) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine
PubChem CID103970448
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine
SMILESCc1nc2ccccc2nc1NCC1(CN)CCCCC1
InChIInChI=1S/C17H24N4/c1-13-16(21-15-8-4-3-7-14(15)20-13)19-12-17(11-18)9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-12,18H2,1H3,(H,19,21)
InChIKeyIATWLAFPSFSCOH-UHFFFAOYSA-N
XLogP3.26
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Methyl-2-piperazin-1-yl-quinoline
CID 598754
2-Quinoxalinecarbonitrile, 3-(4-(2-propenyl)-1-piperazinyl)-
CID 3073499
6,11-Dihydroquinoxalino[2,3-b]quinoxaline
CID 616479
2-Methyl-3-(pyrrolidin-1-yl)quinoxaline
CID 238490
3-benzyl-N-(2-morpholinoethyl)quinoxalin-2-amine
CID 11624425
Vuf-10148
CID 24759623
N'-[7-(4-methylphenyl)pyrido[3,4-b]pyrazin-5-yl]butane-1,4-diamine
CID 66556536
N-cyclohexyl-4-methylquinolin-2-amine
CID 777799
3-Piperazin-1-yl-quinoxaline-2-carbonitrile
CID 9837630
2,3-Quinoxalinediamine, N,N'-diphenyl-
CID 467789
3-(Pyrrolidin-1-yl)quinoxalin-2-amine
CID 2041326
N(1),N(1)-Dimethyl-N(2)-(2-phenyl-4-quinazolinyl)-1,2-ethanediamine
CID 454716

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine (CID 103970448) is N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine is Cc1nc2ccccc2nc1NCC1(CN)CCCCC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine?
The InChIKey is IATWLAFPSFSCOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-13-16(21-15-8-4-3-7-14(15)20-13)19-12-17(11-18)9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-12,18H2,1H3,(H,19,21).
What are the key properties of N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine?
N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine has a molecular weight of 284.41 g/mol, XLogP of 3.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclohexyl]methyl]-3-methylquinoxalin-2-amine is sourced from PubChem (CID 103970448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).