2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide

C16H21N5O2 — CID 50953463

IUPAC2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide
SMILESO=C(CNCC(c1ccco1)N1CCCC1)Nc1cnccn1
InChIInChI=1S/C16H21N5O2/c22-16(20-15-11-17-5-6-19-15)12-18-10-13(14-4-3-9-23-14)21-7-1-2-8-21/h3-6,9,11,13,18H,1-2,7-8,10,12H2,(H,19,20,22)
InChIKeyAVOHDWSSNKYVRK-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.43
Rot. Bonds7

About 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide

2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide (PubChem CID 50953463) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide.

Molecular Properties

Compound Name2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide
PubChem CID50953463
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide
SMILESO=C(CNCC(c1ccco1)N1CCCC1)Nc1cnccn1
InChIInChI=1S/C16H21N5O2/c22-16(20-15-11-17-5-6-19-15)12-18-10-13(14-4-3-9-23-14)21-7-1-2-8-21/h3-6,9,11,13,18H,1-2,7-8,10,12H2,(H,19,20,22)
InChIKeyAVOHDWSSNKYVRK-UHFFFAOYSA-N
XLogP1.43
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide?
The IUPAC name of 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide (CID 50953463) is 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide.
What is the SMILES notation for 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide?
The canonical SMILES for 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide is O=C(CNCC(c1ccco1)N1CCCC1)Nc1cnccn1.
What is the InChIKey of 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide?
The InChIKey is AVOHDWSSNKYVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c22-16(20-15-11-17-5-6-19-15)12-18-10-13(14-4-3-9-23-14)21-7-1-2-8-21/h3-6,9,11,13,18H,1-2,7-8,10,12H2,(H,19,20,22).
What are the key properties of 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide?
2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide has a molecular weight of 315.38 g/mol, XLogP of 1.43, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-N-pyrazin-2-ylacetamide is sourced from PubChem (CID 50953463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).