N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride

C23H29ClN2O2 — CID 24834801

IUPACN-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride
SMILESCCN(C(=O)C(OC)(c1ccccc1)c1ccccc1)C1=CCN(C)CC1.Cl
InChIInChI=1S/C23H28N2O2.ClH/c1-4-25(21-15-17-24(2)18-16-21)22(26)23(27-3,19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-15H,4,16-18H2,1-3H3;1H
InChIKeyUAWRLJDXTJZRFA-UHFFFAOYSA-N
MW400.95 g/mol
LogP4.07
Rot. Bonds6

About N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride

N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride (PubChem CID 24834801) has the molecular formula C23H29ClN2O2 and a molecular weight of 400.95 g/mol. Its IUPAC name is N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride
PubChem CID24834801
Molecular FormulaC23H29ClN2O2
Molecular Weight400.95 g/mol
Exact Mass400.19
IUPAC NameN-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride
SMILESCCN(C(=O)C(OC)(c1ccccc1)c1ccccc1)C1=CCN(C)CC1.Cl
InChIInChI=1S/C23H28N2O2.ClH/c1-4-25(21-15-17-24(2)18-16-21)22(26)23(27-3,19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-15H,4,16-18H2,1-3H3;1H
InChIKeyUAWRLJDXTJZRFA-UHFFFAOYSA-N
XLogP4.07
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.95
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride?
The IUPAC name of N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride (CID 24834801) is N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride.
What is the SMILES notation for N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride?
The canonical SMILES for N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride is CCN(C(=O)C(OC)(c1ccccc1)c1ccccc1)C1=CCN(C)CC1.Cl.
What is the InChIKey of N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride?
The InChIKey is UAWRLJDXTJZRFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2.ClH/c1-4-25(21-15-17-24(2)18-16-21)22(26)23(27-3,19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-15H,4,16-18H2,1-3H3;1H.
What are the key properties of N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride?
N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride has a molecular weight of 400.95 g/mol, XLogP of 4.07, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-N-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-2,2-diphenylacetamide;hydrochloride is sourced from PubChem (CID 24834801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).