1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide

C14H21N3O2 — CID 106319031

IUPAC1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(c2ccc([C@@H](C)O)nc2)C1
InChIInChI=1S/C14H21N3O2/c1-10(18)12-5-4-11(8-16-12)17-7-6-14(2,9-17)13(19)15-3/h4-5,8,10,18H,6-7,9H2,1-3H3,(H,15,19)/t10-,14?/m1/s1
InChIKeyJKSDZQCPWGIASS-IAPIXIRKSA-N
MW263.34 g/mol
LogP1.10
Rot. Bonds3

About 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide

1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide (PubChem CID 106319031) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide
PubChem CID106319031
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(c2ccc([C@@H](C)O)nc2)C1
InChIInChI=1S/C14H21N3O2/c1-10(18)12-5-4-11(8-16-12)17-7-6-14(2,9-17)13(19)15-3/h4-5,8,10,18H,6-7,9H2,1-3H3,(H,15,19)/t10-,14?/m1/s1
InChIKeyJKSDZQCPWGIASS-IAPIXIRKSA-N
XLogP1.10
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-methyl-3-(methylcarbamoyl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 106318842
1-(6-cyano-3-pyridinyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106150514
1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-4-methylpiperidin-4-ol
CID 83132184
(1S)-1-[5-(3,3-diethylpyrrolidin-1-yl)-2-pyridinyl]ethanol
CID 83131740
1-[5-(3,3,4-trimethylpiperazin-1-yl)-2-pyridinyl]ethanol
CID 83131559
1-(2-fluoro-4-pyridinyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321026
(1R)-1-[5-(3-methoxy-3-methylpiperidin-1-yl)-2-pyridinyl]ethanol
CID 107393509
1-[4-[6-[(1S)-1-hydroxyethyl]-3-pyridinyl]piperazin-1-yl]ethanone
CID 83131846
1-(3-chloro-4-formylphenyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318881
3-methyl-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol
CID 153422486
1-[4-(hydroxymethyl)-3-methylphenyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318999
N,3-dimethyl-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 106322389

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide (CID 106319031) is 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide is CNC(=O)C1(C)CCN(c2ccc([C@@H](C)O)nc2)C1.
What is the InChIKey of 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide?
The InChIKey is JKSDZQCPWGIASS-IAPIXIRKSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-10(18)12-5-4-11(8-16-12)17-7-6-14(2,9-17)13(19)15-3/h4-5,8,10,18H,6-7,9H2,1-3H3,(H,15,19)/t10-,14?/m1/s1.
What are the key properties of 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide?
1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]-N,3-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106319031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).