6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine

C11H19NO — CID 176564915

IUPAC6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine
SMILESC/C=C\C1=C(CC)OCCC1NC
InChIInChI=1S/C11H19NO/c1-4-6-9-10(12-3)7-8-13-11(9)5-2/h4,6,10,12H,5,7-8H2,1-3H3/b6-4-
InChIKeyBMALNRCXANOCPO-XQRVVYSFSA-N
MW181.28 g/mol
LogP2.23
Rot. Bonds3

About 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine

6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine (PubChem CID 176564915) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine.

Molecular Properties

Compound Name6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine
PubChem CID176564915
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine
SMILESC/C=C\C1=C(CC)OCCC1NC
InChIInChI=1S/C11H19NO/c1-4-6-9-10(12-3)7-8-13-11(9)5-2/h4,6,10,12H,5,7-8H2,1-3H3/b6-4-
InChIKeyBMALNRCXANOCPO-XQRVVYSFSA-N
XLogP2.23
TPSA21.26 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 ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine?
The IUPAC name of 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine (CID 176564915) is 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine.
What is the SMILES notation for 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine?
The canonical SMILES for 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine is C/C=C\C1=C(CC)OCCC1NC.
What is the InChIKey of 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine?
The InChIKey is BMALNRCXANOCPO-XQRVVYSFSA-N. The full InChI is InChI=1S/C11H19NO/c1-4-6-9-10(12-3)7-8-13-11(9)5-2/h4,6,10,12H,5,7-8H2,1-3H3/b6-4-.
What are the key properties of 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine?
6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine has a molecular weight of 181.28 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran-4-amine is sourced from PubChem (CID 176564915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).