2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide

C16H26N2O3 — CID 60910597

IUPAC2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC(O)COC(C)c1ccccc1
InChIInChI=1S/C16H26N2O3/c1-12(2)18-16(20)10-17-9-15(19)11-21-13(3)14-7-5-4-6-8-14/h4-8,12-13,15,17,19H,9-11H2,1-3H3,(H,18,20)
InChIKeyUZGMDSYDVNBMNF-UHFFFAOYSA-N
MW294.39 g/mol
LogP1.24
Rot. Bonds9

About 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide

2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide (PubChem CID 60910597) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide
PubChem CID60910597
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC(O)COC(C)c1ccccc1
InChIInChI=1S/C16H26N2O3/c1-12(2)18-16(20)10-17-9-15(19)11-21-13(3)14-7-5-4-6-8-14/h4-8,12-13,15,17,19H,9-11H2,1-3H3,(H,18,20)
InChIKeyUZGMDSYDVNBMNF-UHFFFAOYSA-N
XLogP1.24
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-methylacetamide
CID 60901591
methyl 3-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]propanoate
CID 60925192
2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]ethylurea
CID 83121787
1-(1-phenylethoxy)-3-(2,3,3-trimethylbutylamino)propan-2-ol
CID 83142673
1-(2-cyclopropylpropylamino)-3-(1-phenylethoxy)propan-2-ol
CID 115591839
N-[(2R)-2-hydroxy-3-[(1R)-1-phenylethoxy]propyl]cyclopentanecarboxamide
CID 94800865
2-[[3-(2,6-dichlorophenoxy)-2-hydroxypropyl]amino]-N-propan-2-ylacetamide
CID 60909088
2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]oxyacetamide
CID 112673959
1-[(1-methylpyrrolidin-2-yl)methylamino]-3-(1-phenylethoxy)propan-2-ol
CID 106025545
1-(cyclopentylamino)-3-(1-phenylethoxy)propan-2-ol
CID 60635394
1-[(2-ethoxy-2-methylpropyl)amino]-3-(1-phenylethoxy)propan-2-ol
CID 114942117
1-[(1-methylimidazol-2-yl)methylamino]-3-(1-phenylethoxy)propan-2-ol
CID 63000890

Frequently Asked Questions

What is the IUPAC name of 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide (CID 60910597) is 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNCC(O)COC(C)c1ccccc1.
What is the InChIKey of 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide?
The InChIKey is UZGMDSYDVNBMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-12(2)18-16(20)10-17-9-15(19)11-21-13(3)14-7-5-4-6-8-14/h4-8,12-13,15,17,19H,9-11H2,1-3H3,(H,18,20).
What are the key properties of 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide?
2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide has a molecular weight of 294.39 g/mol, XLogP of 1.24, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 60910597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).