(2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide

C16H23N5O3 — CID 98774993

IUPAC(2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide
SMILESCc1nc([C@@H]2CN([C@H](C)C(=O)N(C)Cc3ccco3)CCO2)n[nH]1
InChIInChI=1S/C16H23N5O3/c1-11(16(22)20(3)9-13-5-4-7-23-13)21-6-8-24-14(10-21)15-17-12(2)18-19-15/h4-5,7,11,14H,6,8-10H2,1-3H3,(H,17,18,19)/t11-,14+/m1/s1
InChIKeyXEZWFWHBICCUDJ-RISCZKNCSA-N
MW333.39 g/mol
LogP1.13
Rot. Bonds5

About (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide

(2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide (PubChem CID 98774993) has the molecular formula C16H23N5O3 and a molecular weight of 333.39 g/mol. Its IUPAC name is (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide
PubChem CID98774993
Molecular FormulaC16H23N5O3
Molecular Weight333.39 g/mol
Exact Mass333.18
IUPAC Name(2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide
SMILESCc1nc([C@@H]2CN([C@H](C)C(=O)N(C)Cc3ccco3)CCO2)n[nH]1
InChIInChI=1S/C16H23N5O3/c1-11(16(22)20(3)9-13-5-4-7-23-13)21-6-8-24-14(10-21)15-17-12(2)18-19-15/h4-5,7,11,14H,6,8-10H2,1-3H3,(H,17,18,19)/t11-,14+/m1/s1
InChIKeyXEZWFWHBICCUDJ-RISCZKNCSA-N
XLogP1.13
TPSA87.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-N-[(2S)-1-(furan-2-yl)propan-2-yl]-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide
CID 98774996
2-[(2S)-2-(5-ethyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]-N-(furan-2-ylmethyl)-N-methylacetamide
CID 97059650
(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-4-[(1R)-1-pyridin-4-ylethyl]morpholine
CID 98772589
(2S)-N-(5-methyl-1,3-thiazol-2-yl)-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide
CID 96510651
(2R)-2-chloro-N-(furan-2-ylmethyl)-N-methylpropanamide
CID 42554709
[3-(4-propan-2-ylmorpholin-2-yl)-1H-1,2,4-triazol-5-yl]methanol
CID 79662691
N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-2-piperazin-1-ylpropanamide
CID 64518291
(2R)-1-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 98775062
1-(furan-2-ylmethyl)-3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine
CID 53192047
N-(furan-2-ylmethyl)-N-methyl-2-[(3R)-3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]acetamide
CID 96514191
N-(furan-2-ylmethyl)-N,3-dimethylbutanamide
CID 58845598
(4S)-4-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholine-4-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 96511621

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide?
The IUPAC name of (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide (CID 98774993) is (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide.
What is the SMILES notation for (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide?
The canonical SMILES for (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide is Cc1nc([C@@H]2CN([C@H](C)C(=O)N(C)Cc3ccco3)CCO2)n[nH]1.
What is the InChIKey of (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide?
The InChIKey is XEZWFWHBICCUDJ-RISCZKNCSA-N. The full InChI is InChI=1S/C16H23N5O3/c1-11(16(22)20(3)9-13-5-4-7-23-13)21-6-8-24-14(10-21)15-17-12(2)18-19-15/h4-5,7,11,14H,6,8-10H2,1-3H3,(H,17,18,19)/t11-,14+/m1/s1.
What are the key properties of (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide?
(2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide has a molecular weight of 333.39 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(furan-2-ylmethyl)-N-methyl-2-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]propanamide is sourced from PubChem (CID 98774993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).