N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride

C18H23ClN2O2 — CID 119272234

IUPACN-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
SMILESCOc1ccc2cc(CN(C)C(=O)C3CCCN3)ccc2c1.Cl
InChIInChI=1S/C18H22N2O2.ClH/c1-20(18(21)17-4-3-9-19-17)12-13-5-6-15-11-16(22-2)8-7-14(15)10-13;/h5-8,10-11,17,19H,3-4,9,12H2,1-2H3;1H
InChIKeyMUJJATMIACSIHJ-UHFFFAOYSA-N
MW334.85 g/mol
LogP2.98
Rot. Bonds4

About N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride

N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119272234) has the molecular formula C18H23ClN2O2 and a molecular weight of 334.85 g/mol. Its IUPAC name is N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
PubChem CID119272234
Molecular FormulaC18H23ClN2O2
Molecular Weight334.85 g/mol
Exact Mass334.14
IUPAC NameN-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
SMILESCOc1ccc2cc(CN(C)C(=O)C3CCCN3)ccc2c1.Cl
InChIInChI=1S/C18H22N2O2.ClH/c1-20(18(21)17-4-3-9-19-17)12-13-5-6-15-11-16(22-2)8-7-14(15)10-13;/h5-8,10-11,17,19H,3-4,9,12H2,1-2H3;1H
InChIKeyMUJJATMIACSIHJ-UHFFFAOYSA-N
XLogP2.98
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.85
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-methyl-N-(naphthalen-2-ylmethyl)piperidine-2-carboxamide
CID 103808154
(2S)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119705002
(2S)-N-[(4-ethylphenyl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119266906
N-[(4-hydroxy-3-methoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 60962824
N-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 60738708
(2R,3S)-N-[(6-methoxynaphthalen-2-yl)methyl]-N,2-dimethylmorpholine-3-carboxamide;hydrochloride
CID 120919622
N-[(3-methoxy-4-methylsulfanylphenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119309836
(2R)-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 103793972
N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 60717507
(2S)-N-[(3,4-difluorophenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119717254
(2S)-N-benzyl-N-methylpyrrolidine-2-carboxamide
CID 22691346
N-[(4-methoxyphenyl)methyl]-N-methylpiperazine-2-carboxamide
CID 63104350

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride (CID 119272234) is N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride is COc1ccc2cc(CN(C)C(=O)C3CCCN3)ccc2c1.Cl.
What is the InChIKey of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is MUJJATMIACSIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2.ClH/c1-20(18(21)17-4-3-9-19-17)12-13-5-6-15-11-16(22-2)8-7-14(15)10-13;/h5-8,10-11,17,19H,3-4,9,12H2,1-2H3;1H.
What are the key properties of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride?
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 334.85 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119272234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).