2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide

C13H20N2O3 — CID 54874200

IUPAC2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
SMILESCOc1ccccc1CN(CCO)C(=O)C(C)N
InChIInChI=1S/C13H20N2O3/c1-10(14)13(17)15(7-8-16)9-11-5-3-4-6-12(11)18-2/h3-6,10,16H,7-9,14H2,1-2H3
InChIKeyGIOOODWQKYULAM-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.36
Rot. Bonds6

About 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide

2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide (PubChem CID 54874200) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
PubChem CID54874200
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
SMILESCOc1ccccc1CN(CCO)C(=O)C(C)N
InChIInChI=1S/C13H20N2O3/c1-10(14)13(17)15(7-8-16)9-11-5-3-4-6-12(11)18-2/h3-6,10,16H,7-9,14H2,1-2H3
InChIKeyGIOOODWQKYULAM-UHFFFAOYSA-N
XLogP0.36
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-3,3-dimethylbutanamide
CID 61162884
ethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 64593009
2-hydroxyethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 79345926
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]prop-2-enamide
CID 54875824
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-3-(propan-2-ylamino)propanamide
CID 60952867
3-chloro-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
CID 54875800
(2R)-2-amino-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]propanamide
CID 54995705
2,2,2-trifluoroethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 61067842
2-(butan-2-ylamino)-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 60952866
1-(aminomethyl)-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]cyclopropane-1-carboxamide
CID 115452933
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950154
N-(3-hydroxypropyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 167927105

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide?
The IUPAC name of 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide (CID 54874200) is 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide?
The canonical SMILES for 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide is COc1ccccc1CN(CCO)C(=O)C(C)N.
What is the InChIKey of 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide?
The InChIKey is GIOOODWQKYULAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-10(14)13(17)15(7-8-16)9-11-5-3-4-6-12(11)18-2/h3-6,10,16H,7-9,14H2,1-2H3.
What are the key properties of 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide?
2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide has a molecular weight of 252.31 g/mol, XLogP of 0.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide is sourced from PubChem (CID 54874200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).