(5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine

C10H20N2O — CID 129231154

IUPAC(5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine
SMILESCC(C)N1CC2COCC2(CN)C1
InChIInChI=1S/C10H20N2O/c1-8(2)12-3-9-4-13-7-10(9,5-11)6-12/h8-9H,3-7,11H2,1-2H3
InChIKeySMNGDLSAEQCLCB-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.30
Rot. Bonds2

About (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine

(5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine (PubChem CID 129231154) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine.

Molecular Properties

Compound Name(5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine
PubChem CID129231154
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine
SMILESCC(C)N1CC2COCC2(CN)C1
InChIInChI=1S/C10H20N2O/c1-8(2)12-3-9-4-13-7-10(9,5-11)6-12/h8-9H,3-7,11H2,1-2H3
InChIKeySMNGDLSAEQCLCB-UHFFFAOYSA-N
XLogP0.30
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine?
The IUPAC name of (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine (CID 129231154) is (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine.
What is the SMILES notation for (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine?
The canonical SMILES for (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine is CC(C)N1CC2COCC2(CN)C1.
What is the InChIKey of (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine?
The InChIKey is SMNGDLSAEQCLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)12-3-9-4-13-7-10(9,5-11)6-12/h8-9H,3-7,11H2,1-2H3.
What are the key properties of (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine?
(5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine has a molecular weight of 184.28 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-propan-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl)methanamine is sourced from PubChem (CID 129231154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).