(3R)-N-(2-methylprop-2-enyl)oxolan-3-amine

C8H15NO — CID 163433163

IUPAC(3R)-N-(2-methylprop-2-enyl)oxolan-3-amine
SMILESC=C(C)CN[C@@H]1CCOC1
InChIInChI=1S/C8H15NO/c1-7(2)5-9-8-3-4-10-6-8/h8-9H,1,3-6H2,2H3/t8-/m1/s1
InChIKeyASFWEBFYDXOMPO-MRVPVSSYSA-N
MW141.21 g/mol
LogP0.94
Rot. Bonds3

About (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine

(3R)-N-(2-methylprop-2-enyl)oxolan-3-amine (PubChem CID 163433163) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine.

Molecular Properties

Compound Name(3R)-N-(2-methylprop-2-enyl)oxolan-3-amine
PubChem CID163433163
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(3R)-N-(2-methylprop-2-enyl)oxolan-3-amine
SMILESC=C(C)CN[C@@H]1CCOC1
InChIInChI=1S/C8H15NO/c1-7(2)5-9-8-3-4-10-6-8/h8-9H,1,3-6H2,2H3/t8-/m1/s1
InChIKeyASFWEBFYDXOMPO-MRVPVSSYSA-N
XLogP0.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethoxyethyl)-2-methylprop-2-en-1-amine
CID 60061045
N-(prop-2-en-1-yl)oxolan-3-amine
CID 63331555
4-Ethyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 68827316
N-(2-methylidenebutyl)oxolan-3-amine
CID 80712888
N-(3-methyl-2-methylidenebut-3-enyl)oxolan-3-amine
CID 90880975
2,2-Dimethyl-4-prop-1-en-2-yl-1,3-oxazolidine
CID 123617138
(3R)-N-prop-1-en-2-yloxolan-3-amine
CID 129016954
(4R)-2,2-dimethyl-4-prop-1-en-2-yl-1,3-oxazolidine
CID 144558600
N-(1-methoxypropan-2-yl)-2-methylprop-2-en-1-amine
CID 60688533
N-(2-butoxyethyl)-2-methylprop-2-en-1-amine
CID 62331351
N-(1-ethoxypropan-2-yl)-2-methylprop-2-en-1-amine
CID 62331544
1-methoxy-N-(2-methylprop-2-enyl)butan-2-amine
CID 64411750

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine?
The IUPAC name of (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine (CID 163433163) is (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine.
What is the SMILES notation for (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine?
The canonical SMILES for (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine is C=C(C)CN[C@@H]1CCOC1.
What is the InChIKey of (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine?
The InChIKey is ASFWEBFYDXOMPO-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H15NO/c1-7(2)5-9-8-3-4-10-6-8/h8-9H,1,3-6H2,2H3/t8-/m1/s1.
What are the key properties of (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine?
(3R)-N-(2-methylprop-2-enyl)oxolan-3-amine has a molecular weight of 141.21 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-methylprop-2-enyl)oxolan-3-amine is sourced from PubChem (CID 163433163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).