2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride

C18H29ClN2O3 — CID 119825135

IUPAC2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
SMILESCCCN(C(=O)Cc1c(OC)cccc1OC)C1CCNCC1.Cl
InChIInChI=1S/C18H28N2O3.ClH/c1-4-12-20(14-8-10-19-11-9-14)18(21)13-15-16(22-2)6-5-7-17(15)23-3;/h5-7,14,19H,4,8-13H2,1-3H3;1H
InChIKeySAIMIVPHYZCAGZ-UHFFFAOYSA-N
MW356.89 g/mol
LogP2.66
Rot. Bonds7

About 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride

2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride (PubChem CID 119825135) has the molecular formula C18H29ClN2O3 and a molecular weight of 356.89 g/mol. Its IUPAC name is 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
PubChem CID119825135
Molecular FormulaC18H29ClN2O3
Molecular Weight356.89 g/mol
Exact Mass356.19
IUPAC Name2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
SMILESCCCN(C(=O)Cc1c(OC)cccc1OC)C1CCNCC1.Cl
InChIInChI=1S/C18H28N2O3.ClH/c1-4-12-20(14-8-10-19-11-9-14)18(21)13-15-16(22-2)6-5-7-17(15)23-3;/h5-7,14,19H,4,8-13H2,1-3H3;1H
InChIKeySAIMIVPHYZCAGZ-UHFFFAOYSA-N
XLogP2.66
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.89
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119826026
N-piperidin-4-yl-2-(2-propan-2-yloxyphenyl)-N-propylacetamide
CID 119823731
2-(5-chloro-2-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 119529826
3-(2-methoxyphenoxy)-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 119530663
2-phenyl-N-propyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119532603
2-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 60807367
naphthalen-1-yl N-piperidin-4-yl-N-propylcarbamate;hydrochloride
CID 18372776
2-(2-tert-butylphenoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119824866
4-(2,3-dichlorophenoxy)-N-piperidin-4-yl-N-propylbutanamide;hydrochloride
CID 119825419
3-methoxy-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823113
3-(3,4-dimethoxyphenyl)sulfanyl-N-piperidin-4-yl-N-propylpropanamide
CID 119825082
2-(1,2-oxazol-3-yl)-N-piperidin-4-yl-N-propylacetamide;dihydrochloride
CID 91659773

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The IUPAC name of 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride (CID 119825135) is 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride.
What is the SMILES notation for 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The canonical SMILES for 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride is CCCN(C(=O)Cc1c(OC)cccc1OC)C1CCNCC1.Cl.
What is the InChIKey of 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
The InChIKey is SAIMIVPHYZCAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3.ClH/c1-4-12-20(14-8-10-19-11-9-14)18(21)13-15-16(22-2)6-5-7-17(15)23-3;/h5-7,14,19H,4,8-13H2,1-3H3;1H.
What are the key properties of 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride?
2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride has a molecular weight of 356.89 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethoxyphenyl)-N-piperidin-4-yl-N-propylacetamide;hydrochloride is sourced from PubChem (CID 119825135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).