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

C10H19NO — CID 102647144

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)C(N)C1=CCCCO1
InChIInChI=1S/C10H19NO/c1-10(2,3)9(11)8-6-4-5-7-12-8/h6,9H,4-5,7,11H2,1-3H3
InChIKeyCBIJTYPPWHTAFS-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.05
Rot. Bonds1

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

1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine (PubChem CID 102647144) 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)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine
PubChem CID102647144
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)C(N)C1=CCCCO1
InChIInChI=1S/C10H19NO/c1-10(2,3)9(11)8-6-4-5-7-12-8/h6,9H,4-5,7,11H2,1-3H3
InChIKeyCBIJTYPPWHTAFS-UHFFFAOYSA-N
XLogP2.05
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.05
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
3,4-dihydro-2H-pyran-6-yl-(2-fluoro-1-methylcyclopropyl)methanamine
CID 131015027
(1R)-1-(2,3-dimethyl-2,3-dihydrofuran-5-yl)-2-methylpropan-1-amine
CID 89017377
(1R)-2,2-dimethyl-1-(2-methyl-2,3-dihydrofuran-5-yl)propan-1-amine
CID 89017378
(1R)-2-methyl-1-(2-methyl-2,3-dihydrofuran-5-yl)propan-1-amine
CID 89017392
6-(1-aminoethyl)-2-methyl-3,4-dihydro-2H-pyran-3-amine
CID 123788725
(Z)-2-methyl-4-prop-1-en-2-yloxyhex-4-en-3-amine
CID 142180393
(1R)-2,2-dimethyl-1-(3-methyl-2,3-dihydrofuran-5-yl)propan-1-amine
CID 142180522
3,4-dihydro-2H-pyran-6-ylmethanamine;ethane
CID 142274774
(Z)-4-ethoxy-2-methylhex-4-en-3-amine
CID 142810073
(Z,3R)-4-ethoxyhex-4-en-3-amine
CID 142810338
(1R)-1-(5-tert-butyl-2,3-dihydrooxepin-7-yl)propan-1-amine
CID 142810454

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine (CID 102647144) is 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine is CC(C)(C)C(N)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine?
The InChIKey is CBIJTYPPWHTAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10(2,3)9(11)8-6-4-5-7-12-8/h6,9H,4-5,7,11H2,1-3H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine?
1-(3,4-dihydro-2H-pyran-6-yl)-2,2-dimethylpropan-1-amine has a molecular weight of 169.27 g/mol, XLogP of 2.05, 1 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)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 102647144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).