1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine

C13H24N2O — CID 102647687

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
SMILESCC(C)(C(N)C1=CCCCO1)N1CCCC1
InChIInChI=1S/C13H24N2O/c1-13(2,15-8-4-5-9-15)12(14)11-7-3-6-10-16-11/h7,12H,3-6,8-10,14H2,1-2H3
InChIKeyLIRBCKDLZWQQMC-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.88
Rot. Bonds3

About 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine

1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine (PubChem CID 102647687) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
PubChem CID102647687
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
SMILESCC(C)(C(N)C1=CCCCO1)N1CCCC1
InChIInChI=1S/C13H24N2O/c1-13(2,15-8-4-5-9-15)12(14)11-7-3-6-10-16-11/h7,12H,3-6,8-10,14H2,1-2H3
InChIKeyLIRBCKDLZWQQMC-UHFFFAOYSA-N
XLogP1.88
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(azepan-1-yl)-1-(2,3-dihydrofuran-5-yl)-2-methylpropan-1-amine
CID 102651808
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-piperidin-1-ylpropyl]hydrazine
CID 102650042
[1-(2,3-dihydrofuran-5-yl)-2-methyl-2-pyrrolidin-1-ylpropyl]hydrazine
CID 102654218
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-piperidin-1-yl-N-propylpropan-1-amine
CID 102647694
2-tert-butylsulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanamine
CID 102647524
1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-2-methylbutan-1-amine
CID 102648095
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethyl-N-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 102647727
3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine
CID 102647873
[2-tert-butylsulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)ethyl]hydrazine
CID 102649995
1-(2,3-dihydrofuran-5-yl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 102651812
2-methyl-1-(5-methylthiophen-3-yl)-2-pyrrolidin-1-ylpropan-1-amine
CID 79056215
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-2-methylpropyl]hydrazine
CID 102650063

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine (CID 102647687) is 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine is CC(C)(C(N)C1=CCCCO1)N1CCCC1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is LIRBCKDLZWQQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-13(2,15-8-4-5-9-15)12(14)11-7-3-6-10-16-11/h7,12H,3-6,8-10,14H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine?
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 224.35 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 102647687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).