3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide

C15H22N2O2 — CID 114761937

IUPAC3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
SMILESCOc1cc(C(=O)NCC2(C)CCCN2)ccc1C
InChIInChI=1S/C15H22N2O2/c1-11-5-6-12(9-13(11)19-3)14(18)16-10-15(2)7-4-8-17-15/h5-6,9,17H,4,7-8,10H2,1-3H3,(H,16,18)
InChIKeyJODSSYSYGRMJID-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.88
Rot. Bonds4

About 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide

3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide (PubChem CID 114761937) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
PubChem CID114761937
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
SMILESCOc1cc(C(=O)NCC2(C)CCCN2)ccc1C
InChIInChI=1S/C15H22N2O2/c1-11-5-6-12(9-13(11)19-3)14(18)16-10-15(2)7-4-8-17-15/h5-6,9,17H,4,7-8,10H2,1-3H3,(H,16,18)
InChIKeyJODSSYSYGRMJID-UHFFFAOYSA-N
XLogP1.88
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-methylbenzamide;hydrochloride
CID 120892173
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-3-methoxy-4-methylbenzamide
CID 114751787
2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
CID 114761721
N-[(2-methylpyrrolidin-2-yl)methyl]furan-3-carboxamide
CID 114761851
N-[(2-methylpyrrolidin-2-yl)methyl]-3-(trifluoromethyl)benzamide
CID 114761880
2,5-dihydroxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
CID 107721880
3-methoxy-4-methyl-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119509893
N-[1-(hydroxymethyl)cyclopentyl]-3-methoxy-4-methylbenzamide
CID 62516961
N-(2-aminoethyl)-3-methoxy-4-methylbenzamide
CID 18071038
1-[(3-methoxy-4-methylbenzoyl)amino]cyclobutane-1-carboxylic acid
CID 81158397
4-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-3-methoxybenzamide
CID 104783189
N-[2-(cyclopropanecarbonylamino)ethyl]-3-methoxy-4-methylbenzamide
CID 47120108

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
The IUPAC name of 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide (CID 114761937) is 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide.
What is the SMILES notation for 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
The canonical SMILES for 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide is COc1cc(C(=O)NCC2(C)CCCN2)ccc1C.
What is the InChIKey of 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
The InChIKey is JODSSYSYGRMJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-5-6-12(9-13(11)19-3)14(18)16-10-15(2)7-4-8-17-15/h5-6,9,17H,4,7-8,10H2,1-3H3,(H,16,18).
What are the key properties of 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide?
3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide has a molecular weight of 262.35 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide is sourced from PubChem (CID 114761937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).