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

C11H19NO — CID 102649079

IUPAC2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine
SMILESCC(C1CC1)C(N)C1=CCCCO1
InChIInChI=1S/C11H19NO/c1-8(9-5-6-9)11(12)10-4-2-3-7-13-10/h4,8-9,11H,2-3,5-7,12H2,1H3
InChIKeyHQXSJQLCQDAGDO-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.05
Rot. Bonds3

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

2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine (PubChem CID 102649079) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine
PubChem CID102649079
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine
SMILESCC(C1CC1)C(N)C1=CCCCO1
InChIInChI=1S/C11H19NO/c1-8(9-5-6-9)11(12)10-4-2-3-7-13-10/h4,8-9,11H,2-3,5-7,12H2,1H3
InChIKeyHQXSJQLCQDAGDO-UHFFFAOYSA-N
XLogP2.05
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Cyclopropyl-3-methoxycyclohex-2-en-1-amine
CID 70276253
1-(3,4-dihydro-2H-pyran-6-yl)-3-methylbutan-1-amine
CID 102647130
cyclohexyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647140
cyclopropyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647142
cyclopentyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647236
1-(3,4-dihydro-2H-pyran-6-yl)-4-methylpentan-1-amine
CID 102647276
1-(3,4-dihydro-2H-pyran-6-yl)-N,4-dimethylpentan-1-amine
CID 102647277
3,4-dihydro-2H-pyran-6-yl-(4-methylcyclohexyl)methanamine
CID 102647314
1-(3,4-dihydro-2H-pyran-6-yl)-2-methylbutan-1-amine
CID 102647444
cyclobutyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647501
3,4-dihydro-2H-pyran-6-yl-(4-ethylcyclohexyl)methanamine
CID 102647577
cycloheptyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647585

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine (CID 102649079) is 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine is CC(C1CC1)C(N)C1=CCCCO1.
What is the InChIKey of 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine?
The InChIKey is HQXSJQLCQDAGDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8(9-5-6-9)11(12)10-4-2-3-7-13-10/h4,8-9,11H,2-3,5-7,12H2,1H3.
What are the key properties of 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine?
2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-amine is sourced from PubChem (CID 102649079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).