ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine

C14H26N4O2 — CID 142566784

IUPACethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine
SMILESCC.COCC1CN(c2cnc(N)cc2OC)CCN1
InChIInChI=1S/C12H20N4O2.C2H6/c1-17-8-9-7-16(4-3-14-9)10-6-15-12(13)5-11(10)18-2;1-2/h5-6,9,14H,3-4,7-8H2,1-2H3,(H2,13,15);1-2H3
InChIKeyKRTPYSIGJIWOSC-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.12
Rot. Bonds4

About ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine

ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine (PubChem CID 142566784) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine.

Molecular Properties

Compound Nameethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine
PubChem CID142566784
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Nameethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine
SMILESCC.COCC1CN(c2cnc(N)cc2OC)CCN1
InChIInChI=1S/C12H20N4O2.C2H6/c1-17-8-9-7-16(4-3-14-9)10-6-15-12(13)5-11(10)18-2;1-2/h5-6,9,14H,3-4,7-8H2,1-2H3,(H2,13,15);1-2H3
InChIKeyKRTPYSIGJIWOSC-UHFFFAOYSA-N
XLogP1.12
TPSA72.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-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

Frequently Asked Questions

What is the IUPAC name of ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine?
The IUPAC name of ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine (CID 142566784) is ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine.
What is the SMILES notation for ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine?
The canonical SMILES for ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine is CC.COCC1CN(c2cnc(N)cc2OC)CCN1.
What is the InChIKey of ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine?
The InChIKey is KRTPYSIGJIWOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2.C2H6/c1-17-8-9-7-16(4-3-14-9)10-6-15-12(13)5-11(10)18-2;1-2/h5-6,9,14H,3-4,7-8H2,1-2H3,(H2,13,15);1-2H3.
What are the key properties of ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine?
ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine has a molecular weight of 282.39 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methoxy-5-[3-(methoxymethyl)piperazin-1-yl]pyridin-2-amine is sourced from PubChem (CID 142566784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).