N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine

C11H17N7 — CID 60981442

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
SMILESCCN1CCCC1CNc1cncc2nnnn12
InChIInChI=1S/C11H17N7/c1-2-17-5-3-4-9(17)6-13-10-7-12-8-11-14-15-16-18(10)11/h7-9,13H,2-6H2,1H3
InChIKeyHENVMBBQPCHVDM-UHFFFAOYSA-N
MW247.31 g/mol
LogP0.42
Rot. Bonds4

About N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine

N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine (PubChem CID 60981442) has the molecular formula C11H17N7 and a molecular weight of 247.31 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
PubChem CID60981442
Molecular FormulaC11H17N7
Molecular Weight247.31 g/mol
Exact Mass247.15
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
SMILESCCN1CCCC1CNc1cncc2nnnn12
InChIInChI=1S/C11H17N7/c1-2-17-5-3-4-9(17)6-13-10-7-12-8-11-14-15-16-18(10)11/h7-9,13H,2-6H2,1H3
InChIKeyHENVMBBQPCHVDM-UHFFFAOYSA-N
XLogP0.42
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine (CID 60981442) is N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine is CCN1CCCC1CNc1cncc2nnnn12.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
The InChIKey is HENVMBBQPCHVDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7/c1-2-17-5-3-4-9(17)6-13-10-7-12-8-11-14-15-16-18(10)11/h7-9,13H,2-6H2,1H3.
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine has a molecular weight of 247.31 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]tetrazolo[1,5-a]pyrazin-5-amine is sourced from PubChem (CID 60981442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).