7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine

C12H17NO — CID 43511879

IUPAC7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCCCNC1COc2c(C)cccc21
InChIInChI=1S/C12H17NO/c1-3-7-13-11-8-14-12-9(2)5-4-6-10(11)12/h4-6,11,13H,3,7-8H2,1-2H3
InChIKeyLZZOMKRLCXMYFO-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.43
Rot. Bonds3

About 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine

7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 43511879) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
PubChem CID43511879
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCCCNC1COc2c(C)cccc21
InChIInChI=1S/C12H17NO/c1-3-7-13-11-8-14-12-9(2)5-4-6-10(11)12/h4-6,11,13H,3,7-8H2,1-2H3
InChIKeyLZZOMKRLCXMYFO-UHFFFAOYSA-N
XLogP2.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 43511874
N-butyl-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 43759380
8-fluoro-7-methyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 107659828
8-ethyl-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 43512680
7-methyl-4-propan-2-yl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 54909810
8,9-dimethyl-N-propyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 43512197
N'-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)ethane-1,2-diamine
CID 60888767
5-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 43511864
7-chloro-N-(2-fluoroethyl)-2,3-dihydro-1-benzofuran-3-amine
CID 131089948
N-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)butanamide
CID 110478605
3-[(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]propanoic acid
CID 43774861
9-methyl-N-[(2-methylphenyl)methyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 60912773

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine (CID 43511879) is 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine is CCCNC1COc2c(C)cccc21.
What is the InChIKey of 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is LZZOMKRLCXMYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-3-7-13-11-8-14-12-9(2)5-4-6-10(11)12/h4-6,11,13H,3,7-8H2,1-2H3.
What are the key properties of 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine?
7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 191.27 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 43511879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).