N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide

C14H21N3O2 — CID 129381345

IUPACN-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide
SMILESC[C@@H](c1ccncc1)N(C)C(=O)C[C@H]1COCCN1
InChIInChI=1S/C14H21N3O2/c1-11(12-3-5-15-6-4-12)17(2)14(18)9-13-10-19-8-7-16-13/h3-6,11,13,16H,7-10H2,1-2H3/t11-,13-/m0/s1
InChIKeyPMSWYLBMEQVBCC-AAEUAGOBSA-N
MW263.34 g/mol
LogP0.98
Rot. Bonds4

About N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide

N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide (PubChem CID 129381345) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide
PubChem CID129381345
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide
SMILESC[C@@H](c1ccncc1)N(C)C(=O)C[C@H]1COCCN1
InChIInChI=1S/C14H21N3O2/c1-11(12-3-5-15-6-4-12)17(2)14(18)9-13-10-19-8-7-16-13/h3-6,11,13,16H,7-10H2,1-2H3/t11-,13-/m0/s1
InChIKeyPMSWYLBMEQVBCC-AAEUAGOBSA-N
XLogP0.98
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-morpholin-3-yl-3-pyridin-4-ylpropan-2-one
CID 116595856
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-morpholin-3-ylacetamide
CID 103188714
N-[1-(4-methoxyphenyl)ethyl]-N-methyl-2-pyrrolidin-2-ylacetamide
CID 119704713
N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-thiomorpholin-3-ylacetamide
CID 66421451
3-amino-N-methyl-N-(1-pyridin-4-ylethyl)propanamide
CID 60962964
N-[(5-bromothiophen-2-yl)methyl]-N-methyl-2-morpholin-3-ylacetamide
CID 115178142
N-methyl-2-(propan-2-ylamino)-N-(1-pyridin-4-ylethyl)acetamide
CID 54874161
2-morpholin-3-yl-1-pyridin-3-ylethanone
CID 115777328
N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide
CID 115178159
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-morpholin-3-ylacetamide
CID 81349518
N-[(4-methyl-3-pyridinyl)methyl]-2-morpholin-3-ylacetamide
CID 114956082
N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide
CID 107067802

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide?
The IUPAC name of N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide (CID 129381345) is N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide.
What is the SMILES notation for N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide?
The canonical SMILES for N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide is C[C@@H](c1ccncc1)N(C)C(=O)C[C@H]1COCCN1.
What is the InChIKey of N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide?
The InChIKey is PMSWYLBMEQVBCC-AAEUAGOBSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11(12-3-5-15-6-4-12)17(2)14(18)9-13-10-19-8-7-16-13/h3-6,11,13,16H,7-10H2,1-2H3/t11-,13-/m0/s1.
What are the key properties of N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide?
N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide has a molecular weight of 263.34 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide is sourced from PubChem (CID 129381345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).