N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine

C18H15N3O — CID 170789964

IUPACN-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine
SMILESC[C@@H](Nc1cnccn1)c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C18H15N3O/c1-12(21-18-11-19-8-9-20-18)13-6-7-17-15(10-13)14-4-2-3-5-16(14)22-17/h2-12H,1H3,(H,20,21)/t12-/m1/s1
InChIKeyNSQCBDGQONSRKW-GFCCVEGCSA-N
MW289.34 g/mol
LogP4.55
Rot. Bonds3

About N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine

N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine (PubChem CID 170789964) has the molecular formula C18H15N3O and a molecular weight of 289.34 g/mol. Its IUPAC name is N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine
PubChem CID170789964
Molecular FormulaC18H15N3O
Molecular Weight289.34 g/mol
Exact Mass289.12
IUPAC NameN-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine
SMILESC[C@@H](Nc1cnccn1)c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C18H15N3O/c1-12(21-18-11-19-8-9-20-18)13-6-7-17-15(10-13)14-4-2-3-5-16(14)22-17/h2-12H,1H3,(H,20,21)/t12-/m1/s1
InChIKeyNSQCBDGQONSRKW-GFCCVEGCSA-N
XLogP4.55
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-dibenzofuran-2-ylethyl)hydroxylamine
CID 14234879
N-[1-(5-methoxy-3-methyl-1-benzofuran-2-yl)ethyl]pyrazin-2-amine
CID 133291938
N-[1-(4-fluorophenyl)ethyl]pyrazin-2-amine
CID 60631879
1-dibenzofuran-2-ylethanamine;hydrochloride
CID 13012128
(1S)-1-dibenzofuran-2-ylethanol
CID 82758937
2-[(1S)-1-chloroethyl]dibenzofuran
CID 129370090
(S)-N-[(1R)-1-dibenzofuran-2-ylethyl]-2-methylpropane-2-sulfinamide
CID 176891324
N-(1-thiophen-3-ylethyl)pyrazin-2-amine
CID 62845252
N-[1-(1H-pyrazol-5-yl)ethyl]dibenzofuran-2-amine
CID 60972775
1-dibenzofuran-2-yl-3-methylbutan-1-amine
CID 43100935
2-dibenzofuran-2-yl-N-methylpropanamide
CID 163614988
5-(1-dibenzofuran-2-ylethylamino)-2-[(E)-2-methyl-1-sulfanylbut-1-enyl]-3-(2-oxopropyl)pyrimidin-4-one
CID 170789530

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine?
The IUPAC name of N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine (CID 170789964) is N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine.
What is the SMILES notation for N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine?
The canonical SMILES for N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine is C[C@@H](Nc1cnccn1)c1ccc2oc3ccccc3c2c1.
What is the InChIKey of N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine?
The InChIKey is NSQCBDGQONSRKW-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H15N3O/c1-12(21-18-11-19-8-9-20-18)13-6-7-17-15(10-13)14-4-2-3-5-16(14)22-17/h2-12H,1H3,(H,20,21)/t12-/m1/s1.
What are the key properties of N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine?
N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine has a molecular weight of 289.34 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine is sourced from PubChem (CID 170789964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).