1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine

C10H19NO — CID 102651545

IUPAC1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine
SMILESCCC(C)C(NC)C1=CCCO1
InChIInChI=1S/C10H19NO/c1-4-8(2)10(11-3)9-6-5-7-12-9/h6,8,10-11H,4-5,7H2,1-3H3
InChIKeyJWAGJIXRODYPMF-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.92
Rot. Bonds4

About 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine

1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine (PubChem CID 102651545) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine
PubChem CID102651545
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine
SMILESCCC(C)C(NC)C1=CCCO1
InChIInChI=1S/C10H19NO/c1-4-8(2)10(11-3)9-6-5-7-12-9/h6,8,10-11H,4-5,7H2,1-3H3
InChIKeyJWAGJIXRODYPMF-UHFFFAOYSA-N
XLogP1.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-methylpropan-1-amine
CID 102651911
2-cyclopropyl-1-(2,3-dihydrofuran-5-yl)-2-ethoxy-N-methylethanamine
CID 102652211
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-N-propylbutan-1-amine
CID 102647447
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2-methoxybutan-1-amine
CID 102652185
1-(2,3-dihydrofuran-5-yl)-2-methoxy-N-propylpropan-1-amine
CID 102651913
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2-methylsulfonylpropan-1-amine
CID 102653734
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-N,3,3-trimethylbutan-1-amine
CID 102648088
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
CID 102647204
1-(2,3-dihydrofuran-5-yl)-N-ethyl-3-methylpentan-1-amine
CID 102653276
1-(2,3-dihydrofuran-5-yl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 102652083
1-(2,3-dihydrofuran-5-yl)-1-(3-ethylcyclohexyl)-N-methylmethanamine
CID 102651699
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-N-ethylbutan-1-amine
CID 102648061

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine (CID 102651545) is 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine is CCC(C)C(NC)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine?
The InChIKey is JWAGJIXRODYPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-8(2)10(11-3)9-6-5-7-12-9/h6,8,10-11H,4-5,7H2,1-3H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine?
1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine has a molecular weight of 169.27 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-N,2-dimethylbutan-1-amine is sourced from PubChem (CID 102651545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).