2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol

C15H26N4O2 — CID 103056751

IUPAC2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol
SMILESCCCNc1cnc(CN2CCC(OCCO)CC2)cn1
InChIInChI=1S/C15H26N4O2/c1-2-5-16-15-11-17-13(10-18-15)12-19-6-3-14(4-7-19)21-9-8-20/h10-11,14,20H,2-9,12H2,1H3,(H,16,18)
InChIKeyXIEZVMPPVCJNQR-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.27
Rot. Bonds8

About 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol

2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol (PubChem CID 103056751) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol
PubChem CID103056751
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol
SMILESCCCNc1cnc(CN2CCC(OCCO)CC2)cn1
InChIInChI=1S/C15H26N4O2/c1-2-5-16-15-11-17-13(10-18-15)12-19-6-3-14(4-7-19)21-9-8-20/h10-11,14,20H,2-9,12H2,1H3,(H,16,18)
InChIKeyXIEZVMPPVCJNQR-UHFFFAOYSA-N
XLogP1.27
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(4-propan-2-ylpiperidin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103502336
N-methyl-1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidine-4-carboxamide
CID 103056085
2-[1-[[2-(propylamino)-4-pyridinyl]methyl]piperidin-4-yl]oxyethanol
CID 82684948
2-[1-[(5-aminopyrazin-2-yl)methyl]piperidin-4-yl]oxyethanol
CID 103056754
N-propyl-5-[(3,4,5-trimethylpiperazin-1-yl)methyl]pyrazin-2-amine
CID 103056905
2-[1-(pyrazin-2-ylmethyl)piperidin-4-yl]oxyethanol
CID 82691447
2-[1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl]oxyethanol
CID 82693758
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propylpyrazin-2-amine
CID 103056605
N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine
CID 103056216
5-[(3,4-dimethylpiperazin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103056437
5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine
CID 103056582
2-[1-[[5-(ethylamino)pyrazin-2-yl]methyl]pyrrolidin-3-yl]ethanol
CID 103056925

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol?
The IUPAC name of 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol (CID 103056751) is 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol.
What is the SMILES notation for 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol?
The canonical SMILES for 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol is CCCNc1cnc(CN2CCC(OCCO)CC2)cn1.
What is the InChIKey of 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol?
The InChIKey is XIEZVMPPVCJNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-2-5-16-15-11-17-13(10-18-15)12-19-6-3-14(4-7-19)21-9-8-20/h10-11,14,20H,2-9,12H2,1H3,(H,16,18).
What are the key properties of 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol?
2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol has a molecular weight of 294.40 g/mol, XLogP of 1.27, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol is sourced from PubChem (CID 103056751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).