N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine

C12H15N3O — CID 106887323

IUPACN-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine
SMILESCC(C)NCc1ccc(-c2cnccn2)o1
InChIInChI=1S/C12H15N3O/c1-9(2)15-7-10-3-4-12(16-10)11-8-13-5-6-14-11/h3-6,8-9,15H,7H2,1-2H3
InChIKeyHXMNGRKLFKOZDN-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.23
Rot. Bonds4

About N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine

N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine (PubChem CID 106887323) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine
PubChem CID106887323
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC NameN-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine
SMILESCC(C)NCc1ccc(-c2cnccn2)o1
InChIInChI=1S/C12H15N3O/c1-9(2)15-7-10-3-4-12(16-10)11-8-13-5-6-14-11/h3-6,8-9,15H,7H2,1-2H3
InChIKeyHXMNGRKLFKOZDN-UHFFFAOYSA-N
XLogP2.23
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine
CID 103625236
N-[(5-quinoxalin-6-ylfuran-2-yl)methyl]propan-2-amine
CID 60961490
N-[(2-pyrazin-2-yl-1,3-thiazol-5-yl)methyl]propan-2-amine
CID 61281155
N-[[5-[4-(trifluoromethyl)-3-pyridinyl]furan-2-yl]methyl]propan-2-amine
CID 106888255
N-[[5-(2-methylpyrazol-3-yl)furan-2-yl]methyl]propan-2-amine
CID 106887263
N-[[5-[4-(2-methylpropyl)phenyl]furan-2-yl]methyl]propan-2-amine
CID 106888608
N-[(2-methoxy-5-pyrazin-2-ylphenyl)methyl]propan-2-amine
CID 63970454
1-[4-[5-[(propan-2-ylamino)methyl]furan-2-yl]phenyl]ethanol;hydrochloride
CID 17156433
N-[[5-(4-bromo-3,5-dimethylphenyl)furan-2-yl]methyl]propan-2-amine
CID 107577096
N-[[5-(2-chloro-4,5-dimethylphenyl)furan-2-yl]methyl]propan-2-amine
CID 106889009
N-[[5-(4-butylphenyl)furan-2-yl]methyl]propan-2-amine
CID 43624940
N-[[5-(4-bromo-3-fluorophenyl)furan-2-yl]methyl]propan-2-amine
CID 65435627

Frequently Asked Questions

What is the IUPAC name of N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine?
The IUPAC name of N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine (CID 106887323) is N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine is CC(C)NCc1ccc(-c2cnccn2)o1.
What is the InChIKey of N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine?
The InChIKey is HXMNGRKLFKOZDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-9(2)15-7-10-3-4-12(16-10)11-8-13-5-6-14-11/h3-6,8-9,15H,7H2,1-2H3.
What are the key properties of N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine?
N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine has a molecular weight of 217.27 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 106887323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).