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

C10H19NO — CID 102647192

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine
SMILESCNC(C1=CCCCO1)C(C)C
InChIInChI=1S/C10H19NO/c1-8(2)10(11-3)9-6-4-5-7-12-9/h6,8,10-11H,4-5,7H2,1-3H3
InChIKeyFLHRTSUIHYFZCS-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.92
Rot. Bonds3

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

1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine (PubChem CID 102647192) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine
PubChem CID102647192
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine
SMILESCNC(C1=CCCCO1)C(C)C
InChIInChI=1S/C10H19NO/c1-8(2)10(11-3)9-6-4-5-7-12-9/h6,8,10-11H,4-5,7H2,1-3H3
InChIKeyFLHRTSUIHYFZCS-UHFFFAOYSA-N
XLogP1.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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

2-Butoxy-4-fluoro-6-methylcyclohexa-2,4-dien-1-amine
CID 68244552
2-But-3-en-2-yl-5-(2,2-difluorobutoxy)-1,2,3,6-tetrahydropyridine
CID 91029455
4-fluoro-N-methyl-2-propoxycyclohexa-2,4-dien-1-amine
CID 174310276
1-(3,4-dihydro-2H-pyran-6-yl)-3,3,3-trifluoro-N-methylpropan-1-amine
CID 102647259
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-3,3,3-trifluoropropan-1-amine
CID 102647260
1-(3,4-dihydro-2H-pyran-6-yl)-3,3,3-trifluoro-N-propylpropan-1-amine
CID 102647261
N-[1-(3,4-dihydro-2H-pyran-6-yl)-2,2,2-trifluoroethyl]propan-1-amine
CID 102649135
1-(3,4-dihydro-2H-pyran-6-yl)-3,3,3-trifluoro-N-methyl-2-(trifluoromethyl)propan-1-amine
CID 103312382
1-(3,4-dihydro-2H-pyran-6-yl)-3,3,3-trifluoro-N-propyl-2-(trifluoromethyl)propan-1-amine
CID 103312383
1-(3,4-dihydro-2H-pyran-6-yl)-N-ethyl-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-amine
CID 103312384
N-[1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoroethyl]propan-1-amine
CID 103517265
1-(3,4-dihydro-2H-pyran-6-yl)-2,2-difluoro-N-methylethanamine
CID 103517268

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine (CID 102647192) is 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine is CNC(C1=CCCCO1)C(C)C.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine?
The InChIKey is FLHRTSUIHYFZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-8(2)10(11-3)9-6-4-5-7-12-9/h6,8,10-11H,4-5,7H2,1-3H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine?
1-(3,4-dihydro-2H-pyran-6-yl)-N,2-dimethylpropan-1-amine has a molecular weight of 169.27 g/mol, XLogP of 1.92, 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,2-dimethylpropan-1-amine is sourced from PubChem (CID 102647192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).