N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide

C19H30N4O2 — CID 98718599

IUPACN-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
SMILESC[C@@H]1CN([C@H](C)CNC(=O)c2cccnc2N2CCCC2)C[C@H](C)O1
InChIInChI=1S/C19H30N4O2/c1-14(23-12-15(2)25-16(3)13-23)11-21-19(24)17-7-6-8-20-18(17)22-9-4-5-10-22/h6-8,14-16H,4-5,9-13H2,1-3H3,(H,21,24)/t14-,15-,16+/m1/s1
InChIKeyNYGPKSJKTTTYMK-OAGGEKHMSA-N
MW346.48 g/mol
LogP1.91
Rot. Bonds5

About N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide

N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide (PubChem CID 98718599) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
PubChem CID98718599
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC NameN-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
SMILESC[C@@H]1CN([C@H](C)CNC(=O)c2cccnc2N2CCCC2)C[C@H](C)O1
InChIInChI=1S/C19H30N4O2/c1-14(23-12-15(2)25-16(3)13-23)11-21-19(24)17-7-6-8-20-18(17)22-9-4-5-10-22/h6-8,14-16H,4-5,9-13H2,1-3H3,(H,21,24)/t14-,15-,16+/m1/s1
InChIKeyNYGPKSJKTTTYMK-OAGGEKHMSA-N
XLogP1.91
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide with MolForge

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Related Compounds

2-cyclopentylsulfanyl-N-[(2S)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-3-carboxamide
CID 94647153
N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide
CID 98718393
2-bromo-N-[2-(2,6-dimethylmorpholin-4-yl)propyl]benzamide
CID 46413957
N-[(2R)-2-[(2R)-2-methylpiperidin-1-yl]propyl]-2-morpholin-4-ylpyridine-3-carboxamide
CID 124732893
(2,6-dimethylmorpholin-4-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 134016503
N-ethyl-2-piperidin-1-ylpyridine-3-carboxamide
CID 47231439
2-chloro-N-(2-piperidin-1-ylpropyl)pyridine-3-carboxamide
CID 61053126
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide
CID 42958335
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 51114092
N-[(2R)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propyl]-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 98718256
N-(4-hydroxy-2,2-dimethylpentyl)-2-piperidin-1-ylpyridine-3-carboxamide
CID 111520136
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]-2-hydroxy-5-methylbenzamide
CID 46414109

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide (CID 98718599) is N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide is C[C@@H]1CN([C@H](C)CNC(=O)c2cccnc2N2CCCC2)C[C@H](C)O1.
What is the InChIKey of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide?
The InChIKey is NYGPKSJKTTTYMK-OAGGEKHMSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-14(23-12-15(2)25-16(3)13-23)11-21-19(24)17-7-6-8-20-18(17)22-9-4-5-10-22/h6-8,14-16H,4-5,9-13H2,1-3H3,(H,21,24)/t14-,15-,16+/m1/s1.
What are the key properties of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide?
N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide has a molecular weight of 346.48 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 98718599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).