N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide

C17H26N4O3 — CID 125165325

IUPACN-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCC[C@@H]2CCC(=O)N2CCN(C)C)cn1
InChIInChI=1S/C17H26N4O3/c1-20(2)10-11-21-14(5-7-16(21)22)8-9-18-17(23)13-4-6-15(24-3)19-12-13/h4,6,12,14H,5,7-11H2,1-3H3,(H,18,23)/t14-/m0/s1
InChIKeyHEOJJLXPECHODC-AWEZNQCLSA-N
MW334.42 g/mol
LogP0.76
Rot. Bonds8

About N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide

N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide (PubChem CID 125165325) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide
PubChem CID125165325
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC NameN-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NCC[C@@H]2CCC(=O)N2CCN(C)C)cn1
InChIInChI=1S/C17H26N4O3/c1-20(2)10-11-21-14(5-7-16(21)22)8-9-18-17(23)13-4-6-15(24-3)19-12-13/h4,6,12,14H,5,7-11H2,1-3H3,(H,18,23)/t14-/m0/s1
InChIKeyHEOJJLXPECHODC-AWEZNQCLSA-N
XLogP0.76
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide with MolForge

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Related Compounds

VU0404251
CID 58368068
(4-Cyclobutyl-1,4-diazepan-1-yl)(6-phenoxypyridin-3-yl)methanone
CID 24771416
6-Methoxynicotinamide
CID 250810
[(S)-1-((S)-2-{(S)-3,3-Difluoro-1-isopropyl-2-oxo-4-[(pyridine-3-carbonyl)-amino]-butylcarbamoyl}-pyrrolidine-1-carbonyl)-2-methyl-propyl]-carbamic acid phenyl ester
CID 10579493
N-[3-(3-Methoxy-benzoylamino)-propyl]-nicotinamide
CID 2989253
2-ethoxy-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 4794993
N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]pyridine-3-carbohydrazide
CID 5219821
N-[3-(4-Methoxy-benzoylamino)-propyl]-6-methyl-nicotinamide
CID 6498656
N-(4-methoxyphenyl)-1-(3-pyridinylcarbonyl)-3-piperidinamine
CID 24793000
N-{3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-propyl}-nicotinamide
CID 9998277
N-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-nicotinamide
CID 10067621
(6-(4-Fluorophenoxy)pyridin-3-yl)(4-isopropylpiperazin-1-yl)methanone
CID 24771017

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide (CID 125165325) is N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)NCC[C@@H]2CCC(=O)N2CCN(C)C)cn1.
What is the InChIKey of N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide?
The InChIKey is HEOJJLXPECHODC-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H26N4O3/c1-20(2)10-11-21-14(5-7-16(21)22)8-9-18-17(23)13-4-6-15(24-3)19-12-13/h4,6,12,14H,5,7-11H2,1-3H3,(H,18,23)/t14-/m0/s1.
What are the key properties of N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide?
N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 0.76, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 125165325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).