N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine

C12H19ClN4 — CID 114231610

IUPACN-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine
SMILESNCC1CCC(CNc2cncc(Cl)n2)CC1
InChIInChI=1S/C12H19ClN4/c13-11-7-15-8-12(17-11)16-6-10-3-1-9(5-14)2-4-10/h7-10H,1-6,14H2,(H,16,17)
InChIKeyZBXONWPJNNWKSE-UHFFFAOYSA-N
MW254.76 g/mol
LogP2.31
Rot. Bonds4

About N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine

N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine (PubChem CID 114231610) has the molecular formula C12H19ClN4 and a molecular weight of 254.76 g/mol. Its IUPAC name is N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine.

Molecular Properties

Compound NameN-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine
PubChem CID114231610
Molecular FormulaC12H19ClN4
Molecular Weight254.76 g/mol
Exact Mass254.13
IUPAC NameN-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine
SMILESNCC1CCC(CNc2cncc(Cl)n2)CC1
InChIInChI=1S/C12H19ClN4/c13-11-7-15-8-12(17-11)16-6-10-3-1-9(5-14)2-4-10/h7-10H,1-6,14H2,(H,16,17)
InChIKeyZBXONWPJNNWKSE-UHFFFAOYSA-N
XLogP2.31
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-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

N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine
CID 80932571
6-chloro-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyrazin-2-amine
CID 133446500
6-chloro-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrazin-2-amine
CID 79350173
6-chloro-2-N-(cyclopropylmethyl)pyridine-2,4-diamine
CID 104918835
(E)-N'-(6-chloropyrazin-2-yl)but-2-ene-1,4-diamine
CID 116650934
6-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyrazin-2-amine
CID 80914019
4-[[(6-aminopyrazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106137920
4-[[(6-hydrazinylpyrazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 106138813
N-[(3-aminocyclopentyl)methyl]-6-methoxypyrazin-2-amine
CID 106126810
methyl 6-[(4-methylcyclohexyl)methylamino]pyrazine-2-carboxylate
CID 66455933
2-N-(oxan-4-ylmethyl)pyrazine-2,6-diamine
CID 78989247
N-(cyclohexylmethyl)-6-methoxypyrazin-2-amine
CID 155403653

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine?
The IUPAC name of N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine (CID 114231610) is N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine.
What is the SMILES notation for N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine?
The canonical SMILES for N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine is NCC1CCC(CNc2cncc(Cl)n2)CC1.
What is the InChIKey of N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine?
The InChIKey is ZBXONWPJNNWKSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN4/c13-11-7-15-8-12(17-11)16-6-10-3-1-9(5-14)2-4-10/h7-10H,1-6,14H2,(H,16,17).
What are the key properties of N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine?
N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine has a molecular weight of 254.76 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)cyclohexyl]methyl]-6-chloropyrazin-2-amine is sourced from PubChem (CID 114231610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).