1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine

C9H17NO — CID 102647204

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
SMILESCCC(NC)C1=CCCCO1
InChIInChI=1S/C9H17NO/c1-3-8(10-2)9-6-4-5-7-11-9/h6,8,10H,3-5,7H2,1-2H3
InChIKeyABSJNSPVBCJHRT-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.68
Rot. Bonds3

About 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine

1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine (PubChem CID 102647204) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
PubChem CID102647204
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
SMILESCCC(NC)C1=CCCCO1
InChIInChI=1S/C9H17NO/c1-3-8(10-2)9-6-4-5-7-11-9/h6,8,10H,3-5,7H2,1-2H3
InChIKeyABSJNSPVBCJHRT-UHFFFAOYSA-N
XLogP1.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine
CID 102650409
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-3-methylbutan-1-amine
CID 102647187
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-naphthalen-1-ylethanamine
CID 102649497
2-(4-chlorophenoxy)-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylethanamine
CID 102648745
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-2-(3-methylphenyl)sulfanylethanamine
CID 102647649
2-(2-chlorophenyl)sulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylethanamine
CID 102647655
1-(3-bicyclo[3.1.0]hexanyl)-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
CID 102649558
[1-(3,4-dihydro-2H-pyran-6-yl)-2-propylsulfanylethyl]hydrazine
CID 102649993
1-(3,4-dihydro-2H-pyran-6-yl)-N,N',N'-triethylpropane-1,3-diamine
CID 102647764
1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)-N-methylethanamine
CID 102647849
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 102647225
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 102647624

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine (CID 102647204) is 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine is CCC(NC)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine?
The InChIKey is ABSJNSPVBCJHRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-8(10-2)9-6-4-5-7-11-9/h6,8,10H,3-5,7H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine?
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 102647204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).