6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide

C19H29N3O3 — CID 128982031

IUPAC6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide
SMILESCO[C@H]1C[C@@H](CN(C)C(=O)c2ccc(OC3CCCC3)nc2)N(C)C1
InChIInChI=1S/C19H29N3O3/c1-21-13-17(24-3)10-15(21)12-22(2)19(23)14-8-9-18(20-11-14)25-16-6-4-5-7-16/h8-9,11,15-17H,4-7,10,12-13H2,1-3H3/t15-,17-/m0/s1
InChIKeyAHENBXRBXIDVQE-RDJZCZTQSA-N
MW347.46 g/mol
LogP2.19
Rot. Bonds6

About 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide

6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide (PubChem CID 128982031) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide
PubChem CID128982031
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide
SMILESCO[C@H]1C[C@@H](CN(C)C(=O)c2ccc(OC3CCCC3)nc2)N(C)C1
InChIInChI=1S/C19H29N3O3/c1-21-13-17(24-3)10-15(21)12-22(2)19(23)14-8-9-18(20-11-14)25-16-6-4-5-7-16/h8-9,11,15-17H,4-7,10,12-13H2,1-3H3/t15-,17-/m0/s1
InChIKeyAHENBXRBXIDVQE-RDJZCZTQSA-N
XLogP2.19
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide with MolForge

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Related Compounds

N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 128981958
N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N,3-dimethylbenzotriazole-5-carboxamide
CID 128982032
N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N,3-dimethylpyridine-2-carboxamide
CID 128981937
3-ethyl-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-2-carboxamide
CID 128982012
2-[(6-cyclopentyloxypyridine-3-carbonyl)-methylamino]-2-methylpropanoic acid
CID 120518735
3-[(6-cyclopentyloxypyridine-3-carbonyl)-ethylamino]propanoic acid
CID 120516671
5-[methyl-[(1-methylpyrrolidin-2-yl)methyl]carbamoyl]pyridine-2-carboxylic acid
CID 79315921
4-chloro-2-ethoxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylbenzamide
CID 128987256
6-cyclopentyloxy-N-[2-(dimethylamino)pyrimidin-5-yl]pyridine-3-carboxamide
CID 122298052
2-(cyclopropylmethyl)-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methyl-1,3-oxazole-4-carboxamide
CID 128987272
N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methyl-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 128981939
6-(cyclopropylmethoxy)-N-[(2-hydroxycyclopentyl)methyl]-N-methylpyridine-3-carboxamide
CID 109400138

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide (CID 128982031) is 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide is CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc(OC3CCCC3)nc2)N(C)C1.
What is the InChIKey of 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide?
The InChIKey is AHENBXRBXIDVQE-RDJZCZTQSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-21-13-17(24-3)10-15(21)12-22(2)19(23)14-8-9-18(20-11-14)25-16-6-4-5-7-16/h8-9,11,15-17H,4-7,10,12-13H2,1-3H3/t15-,17-/m0/s1.
What are the key properties of 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide?
6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 2.19, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyloxy-N-[[(2S,4S)-4-methoxy-1-methylpyrrolidin-2-yl]methyl]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 128982031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).