3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine

C10H17NO — CID 102647873

IUPAC3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine
SMILESCC1(C(N)C2=CCCCO2)CC1
InChIInChI=1S/C10H17NO/c1-10(5-6-10)9(11)8-4-2-3-7-12-8/h4,9H,2-3,5-7,11H2,1H3
InChIKeyHTFOFHCGNZMHJV-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.81
Rot. Bonds2

About 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine

3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine (PubChem CID 102647873) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine
PubChem CID102647873
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine
SMILESCC1(C(N)C2=CCCCO2)CC1
InChIInChI=1S/C10H17NO/c1-10(5-6-10)9(11)8-4-2-3-7-12-8/h4,9H,2-3,5-7,11H2,1H3
InChIKeyHTFOFHCGNZMHJV-UHFFFAOYSA-N
XLogP1.81
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanol
CID 102654803
3,4-dihydro-2H-pyran-6-yl-[1-(2-methylpropyl)cyclopentyl]methanamine
CID 102649304
3,4-dihydro-2H-pyran-6-yl-(4-phenyloxan-4-yl)methanamine
CID 102647412
3,4-dihydro-2H-pyran-6-yl-(4-ethoxyoxan-4-yl)methanamine
CID 102648122
[3,4-dihydro-2H-pyran-6-yl-(2-methyloxolan-2-yl)methyl]hydrazine
CID 102650081
2,3-dihydrofuran-5-yl-(1-methoxycycloheptyl)methanamine
CID 102652274
2-butan-2-ylsulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanamine
CID 102647531
1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-pyrrolidin-1-ylpropan-1-amine
CID 102647687
2-tert-butylsulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanamine
CID 102647524
1-(3,4-dihydro-2H-pyran-6-yl)-2,2-diethoxyethanamine
CID 102647793
[3,4-dihydro-2H-pyran-6-yl-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
CID 102650172
[3,4-dihydro-2H-pyran-6-yl-(1-ethylcyclopentyl)methyl]hydrazine
CID 102650304

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine (CID 102647873) is 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine is CC1(C(N)C2=CCCCO2)CC1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine?
The InChIKey is HTFOFHCGNZMHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-10(5-6-10)9(11)8-4-2-3-7-12-8/h4,9H,2-3,5-7,11H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine?
3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine has a molecular weight of 167.25 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-6-yl-(1-methylcyclopropyl)methanamine is sourced from PubChem (CID 102647873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).