3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine

C12H19N3O — CID 82377054

IUPAC3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
SMILESc1occ2c1NCC(CN1CCCCC1)N2
InChIInChI=1S/C12H19N3O/c1-2-4-15(5-3-1)7-10-6-13-11-8-16-9-12(11)14-10/h8-10,13-14H,1-7H2
InChIKeyXIUVXTZDGZJWBM-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.97
Rot. Bonds2

About 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine

3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine (PubChem CID 82377054) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine.

Molecular Properties

Compound Name3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
PubChem CID82377054
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
SMILESc1occ2c1NCC(CN1CCCCC1)N2
InChIInChI=1S/C12H19N3O/c1-2-4-15(5-3-1)7-10-6-13-11-8-16-9-12(11)14-10/h8-10,13-14H,1-7H2
InChIKeyXIUVXTZDGZJWBM-UHFFFAOYSA-N
XLogP1.97
TPSA40.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(Furan-3-yl)-2-(2-methylpropyl)piperazine
CID 59674821
1-(Furan-3-yl)piperazine
CID 63948938
1-(Furan-3-yl)-2-methylpiperazine
CID 70574891
tert-butyl N-[4-[4-(2-oxopiperidin-1-yl)piperidin-1-yl]furan-3-yl]carbamate
CID 71145360
2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one
CID 92546001
4-N-dodecyl-3-N,3-N-dimethylfuran-3,4-diamine
CID 140081847
Ethane;1-(furan-3-yl)piperazine;methoxyethane
CID 142245666
N-(furan-3-yl)-1-methylpiperidin-3-amine
CID 163213114
1,4-dimethylspiro[2H-furo[3,4-b]pyrazine-3,1'-cyclopropane]
CID 170608196
(2R)-1-(furan-3-yl)-2-(2-methylpropyl)piperazine
CID 10236086
1-(Furan-3-yl)piperidin-4-amine
CID 63948940
1-(Furan-3-yl)piperidin-3-amine
CID 63949152

Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
The IUPAC name of 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine (CID 82377054) is 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine.
What is the SMILES notation for 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
The canonical SMILES for 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine is c1occ2c1NCC(CN1CCCCC1)N2.
What is the InChIKey of 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
The InChIKey is XIUVXTZDGZJWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-4-15(5-3-1)7-10-6-13-11-8-16-9-12(11)14-10/h8-10,13-14H,1-7H2.
What are the key properties of 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine has a molecular weight of 221.30 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine is sourced from PubChem (CID 82377054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).