N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide

C15H22N2O3 — CID 106612911

IUPACN-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCOc1ccccc1C(=O)N(CCO)CC1CCCN1
InChIInChI=1S/C15H22N2O3/c1-20-14-7-3-2-6-13(14)15(19)17(9-10-18)11-12-5-4-8-16-12/h2-3,6-7,12,16,18H,4-5,8-11H2,1H3
InChIKeyVNTQQHUZDLSWAR-UHFFFAOYSA-N
MW278.35 g/mol
LogP0.88
Rot. Bonds6

About N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide

N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide (PubChem CID 106612911) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
PubChem CID106612911
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCOc1ccccc1C(=O)N(CCO)CC1CCCN1
InChIInChI=1S/C15H22N2O3/c1-20-14-7-3-2-6-13(14)15(19)17(9-10-18)11-12-5-4-8-16-12/h2-3,6-7,12,16,18H,4-5,8-11H2,1H3
InChIKeyVNTQQHUZDLSWAR-UHFFFAOYSA-N
XLogP0.88
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612263
3-fluoro-N-(2-hydroxyethyl)-4-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106613059
N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)-1H-indole-3-carboxamide
CID 106612620
N-butyl-2-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612351
2,5-dihydroxy-N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107725339
2-hydroxy-3-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607936
2-hydroxy-N-(2-hydroxyethyl)-5-iodo-N-(pyrrolidin-2-ylmethyl)benzamide
CID 107732251
5-chloro-N-ethyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609149
N-(2-hydroxyethyl)-2-(4-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106612506
2-chloro-N-(2-hydroxyethyl)-5-methylsulfanyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612857
N-(2-hydroxyethyl)-N-(pyrrolidin-2-ylmethyl)-1H-indazole-3-carboxamide
CID 106612562
N-(2-hydroxyethyl)-2-(4-methylphenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106612681

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide (CID 106612911) is N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide is COc1ccccc1C(=O)N(CCO)CC1CCCN1.
What is the InChIKey of N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The InChIKey is VNTQQHUZDLSWAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-20-14-7-3-2-6-13(14)15(19)17(9-10-18)11-12-5-4-8-16-12/h2-3,6-7,12,16,18H,4-5,8-11H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide has a molecular weight of 278.35 g/mol, XLogP of 0.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide is sourced from PubChem (CID 106612911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).