(2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide

C19H30N4O2 — CID 124777293

IUPAC(2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide
SMILESC[C@@H]1CN(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)[C@@H](C)CO1
InChIInChI=1S/C19H30N4O2/c1-14-13-25-15(2)12-23(14)19(24)21-18-6-10-22(11-7-18)16(3)17-4-8-20-9-5-17/h4-5,8-9,14-16,18H,6-7,10-13H2,1-3H3,(H,21,24)/t14-,15+,16+/m0/s1
InChIKeySRIUXBPMEPVZQR-ARFHVFGLSA-N
MW346.48 g/mol
LogP2.43
Rot. Bonds3

About (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide

(2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide (PubChem CID 124777293) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide
PubChem CID124777293
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC Name(2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide
SMILESC[C@@H]1CN(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)[C@@H](C)CO1
InChIInChI=1S/C19H30N4O2/c1-14-13-25-15(2)12-23(14)19(24)21-18-6-10-22(11-7-18)16(3)17-4-8-20-9-5-17/h4-5,8-9,14-16,18H,6-7,10-13H2,1-3H3,(H,21,24)/t14-,15+,16+/m0/s1
InChIKeySRIUXBPMEPVZQR-ARFHVFGLSA-N
XLogP2.43
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide with MolForge

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Related Compounds

(2R,5S)-2,5-dimethyl-N-[(3R)-1-pyridin-2-ylpyrrolidin-3-yl]morpholine-4-carboxamide
CID 124616725
1-methyl-N-[1-(1-pyridin-4-ylethyl)piperidin-4-yl]-2,3-dihydro-1H-indene-2-carboxamide
CID 166296337
2,5-dimethyl-N-[1-[(1S)-1-pyridin-4-ylethyl]piperidin-4-yl]benzamide
CID 124591552
1-methyl-1-(2-methylprop-2-enyl)-3-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]urea
CID 124615698
3-methyl-N-[1-[(1S)-1-pyridin-4-ylethyl]piperidin-4-yl]triazolo[4,5-b]pyridine-6-carboxamide
CID 124616754
5-fluoro-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]-1-benzofuran-2-carboxamide
CID 124591641
N-ethyl-1-(1-pyridin-4-ylethyl)piperidin-4-amine
CID 60860637
3-(5-methyl-1,2-oxazol-3-yl)-N-[1-(1-pyridin-4-ylethyl)piperidin-4-yl]propanamide
CID 167941273
3-propan-2-yl-N-[1-[(1S)-1-pyridin-4-ylethyl]piperidin-4-yl]-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 99701439
4,4-difluoro-N-[1-(1-pyridin-4-ylethyl)piperidin-4-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 120955109
1-(5-fluoro-2-pyridinyl)-3-[1-(1-pyridin-4-ylethyl)piperidin-4-yl]urea
CID 126793193
4-fluoro-3-methyl-N-[1-[(1S)-1-pyridin-4-ylethyl]piperidin-4-yl]-1-benzothiophene-2-carboxamide
CID 124591472

Frequently Asked Questions

What is the IUPAC name of (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide?
The IUPAC name of (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide (CID 124777293) is (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide.
What is the SMILES notation for (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide?
The canonical SMILES for (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide is C[C@@H]1CN(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)[C@@H](C)CO1.
What is the InChIKey of (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide?
The InChIKey is SRIUXBPMEPVZQR-ARFHVFGLSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-14-13-25-15(2)12-23(14)19(24)21-18-6-10-22(11-7-18)16(3)17-4-8-20-9-5-17/h4-5,8-9,14-16,18H,6-7,10-13H2,1-3H3,(H,21,24)/t14-,15+,16+/m0/s1.
What are the key properties of (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide?
(2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide has a molecular weight of 346.48 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5S)-2,5-dimethyl-N-[1-[(1R)-1-pyridin-4-ylethyl]piperidin-4-yl]morpholine-4-carboxamide is sourced from PubChem (CID 124777293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).