1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine

C11H21NO — CID 115677339

IUPAC1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine
SMILESCC(NC(C)C1CCOC1)C1CC1
InChIInChI=1S/C11H21NO/c1-8(10-3-4-10)12-9(2)11-5-6-13-7-11/h8-12H,3-7H2,1-2H3
InChIKeyPUXGWBQJGBWSAP-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds4

About 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine

1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine (PubChem CID 115677339) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine
PubChem CID115677339
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine
SMILESCC(NC(C)C1CCOC1)C1CC1
InChIInChI=1S/C11H21NO/c1-8(10-3-4-10)12-9(2)11-5-6-13-7-11/h8-12H,3-7H2,1-2H3
InChIKeyPUXGWBQJGBWSAP-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(oxan-4-yl)-N-[1-(oxolan-3-yl)ethyl]ethanamine
CID 115724018
1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115724005
4-methyl-N-[1-(oxolan-3-yl)ethyl]hexan-2-amine
CID 115892028
N-[1-(oxolan-3-yl)ethyl]hexan-3-amine
CID 115888979
2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol
CID 115919249
1-methylsulfanyl-N-[1-(oxolan-3-yl)ethyl]propan-2-amine
CID 115721709
methyl 2-[1-(oxolan-3-yl)ethylamino]propanoate
CID 115660027
N-[1-(oxolan-3-yl)ethyl]pent-4-yn-2-amine
CID 115725224
5-methyl-N-[1-(oxolan-3-yl)ethyl]heptan-3-amine
CID 115723984
3-methyl-2-[1-(oxolan-3-yl)ethylamino]butanamide
CID 103707651
N-[(4-chlorophenyl)-cyclopropylmethyl]-1-(oxolan-3-yl)ethanamine
CID 115707063
N-[1-(3,5-dimethylphenyl)ethyl]-1-(oxolan-3-yl)ethanamine
CID 115718211

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine (CID 115677339) is 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine is CC(NC(C)C1CCOC1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine?
The InChIKey is PUXGWBQJGBWSAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8(10-3-4-10)12-9(2)11-5-6-13-7-11/h8-12H,3-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine?
1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine has a molecular weight of 183.29 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine is sourced from PubChem (CID 115677339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).