N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine

C13H20N2O — CID 83007266

IUPACN-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine
SMILESc1cc2c(o1)CCCC2NN1CCCCC1
InChIInChI=1S/C13H20N2O/c1-2-8-15(9-3-1)14-12-5-4-6-13-11(12)7-10-16-13/h7,10,12,14H,1-6,8-9H2
InChIKeyPVWGGXPTLSHSFC-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.65
Rot. Bonds2

About N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine

N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine (PubChem CID 83007266) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine.

Molecular Properties

Compound NameN-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine
PubChem CID83007266
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine
SMILESc1cc2c(o1)CCCC2NN1CCCCC1
InChIInChI=1S/C13H20N2O/c1-2-8-15(9-3-1)14-12-5-4-6-13-11(12)7-10-16-13/h7,10,12,14H,1-6,8-9H2
InChIKeyPVWGGXPTLSHSFC-UHFFFAOYSA-N
XLogP2.65
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)azepane-1-sulfonamide
CID 55571263
N-(3-piperidin-1-ylpropyl)-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 115465990
N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)formamide
CID 64990494
N-cyclopentyloxy-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 83229241
N-(2,3,4,5,6-pentafluorophenyl)-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 115564206
N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)pyrrolidin-3-amine
CID 79725054
N-(2-methylcycloheptyl)-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 113315213
N-(2-methoxy-2-methylpropyl)-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 104759614
N-(2,2-difluoroethyl)-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 115466646
4-(4,5,6,7-tetrahydro-1-benzofuran-4-ylamino)cyclohexan-1-ol
CID 113315107
1-propyl-N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-4-amine
CID 43208258
8-methyl-N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 43131794

Frequently Asked Questions

What is the IUPAC name of N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine?
The IUPAC name of N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine (CID 83007266) is N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine.
What is the SMILES notation for N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine?
The canonical SMILES for N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine is c1cc2c(o1)CCCC2NN1CCCCC1.
What is the InChIKey of N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine?
The InChIKey is PVWGGXPTLSHSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-8-15(9-3-1)14-12-5-4-6-13-11(12)7-10-16-13/h7,10,12,14H,1-6,8-9H2.
What are the key properties of N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine?
N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine has a molecular weight of 220.32 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)piperidin-1-amine is sourced from PubChem (CID 83007266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).