2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide

C12H24N2O3 — CID 120988887

IUPAC2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCC(O)C1CCCCC1
InChIInChI=1S/C12H24N2O3/c1-17-8-10(13)12(16)14-7-11(15)9-5-3-2-4-6-9/h9-11,15H,2-8,13H2,1H3,(H,14,16)
InChIKeyVNNNSGNRGUDHRJ-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.02
Rot. Bonds6

About 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide

2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide (PubChem CID 120988887) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide
PubChem CID120988887
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCC(O)C1CCCCC1
InChIInChI=1S/C12H24N2O3/c1-17-8-10(13)12(16)14-7-11(15)9-5-3-2-4-6-9/h9-11,15H,2-8,13H2,1H3,(H,14,16)
InChIKeyVNNNSGNRGUDHRJ-UHFFFAOYSA-N
XLogP0.02
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-cyclooctyl-3-methoxypropanamide
CID 81082114
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3-amino-N-(2-cyclohexyl-2-hydroxyethyl)propanamide;hydrochloride
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2-amino-3-methoxy-N-[(4-methylcyclohexyl)methyl]propanamide;hydrochloride
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2-amino-N-(2-cyclohexylcyclopropyl)-3-methoxypropanamide;hydrochloride
CID 120990869
4-[(2-amino-3-methoxypropanoyl)amino]-3-methoxybutanoic acid
CID 103157306
2-amino-N-(4-hydroxy-2-methylbutyl)-3-methoxypropanamide
CID 81102467
2-amino-3-methoxy-N-[2-(oxolan-2-yl)ethyl]propanamide
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide?
The IUPAC name of 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide (CID 120988887) is 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide is COCC(N)C(=O)NCC(O)C1CCCCC1.
What is the InChIKey of 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide?
The InChIKey is VNNNSGNRGUDHRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-17-8-10(13)12(16)14-7-11(15)9-5-3-2-4-6-9/h9-11,15H,2-8,13H2,1H3,(H,14,16).
What are the key properties of 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide?
2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide has a molecular weight of 244.33 g/mol, XLogP of 0.02, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-3-methoxypropanamide is sourced from PubChem (CID 120988887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).