N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide

C12H23NO2 — CID 166437638

IUPACN-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide
SMILESCOCCC(=O)N[C@H](C)C1CCCCC1
InChIInChI=1S/C12H23NO2/c1-10(11-6-4-3-5-7-11)13-12(14)8-9-15-2/h10-11H,3-9H2,1-2H3,(H,13,14)/t10-/m1/s1
InChIKeyGJMQFCKYGSZJFY-SNVBAGLBSA-N
MW213.32 g/mol
LogP2.11
Rot. Bonds5

About N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide

N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide (PubChem CID 166437638) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide
PubChem CID166437638
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide
SMILESCOCCC(=O)N[C@H](C)C1CCCCC1
InChIInChI=1S/C12H23NO2/c1-10(11-6-4-3-5-7-11)13-12(14)8-9-15-2/h10-11H,3-9H2,1-2H3,(H,13,14)/t10-/m1/s1
InChIKeyGJMQFCKYGSZJFY-SNVBAGLBSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-3-methoxypropanamide
CID 62947051
Propanamide, N-(1-cyclohexylethyl)-
CID 541858
N-[(1R)-1-cyclohexylethyl]acetamide
CID 13617462
11,11,15-Trimethyl-6-oxa-2,10-diazabicyclo[10.3.1]hexadecane-3,9-dione
CID 376000
N-(3-methoxypropyl)-2-[(2-methylcyclohexyl)amino]propanamide
CID 43112624
N-(2,6-dimethylcyclohexyl)-3-(2-methoxyethoxy)propanamide
CID 72047406
3-(2,2-difluoroethoxy)-N-(3,4-dimethylcyclohexyl)propanamide
CID 121517768
N-(3-methoxypropyl)cyclohexanecarboxamide
CID 4191027
N-[(1S)-1-cyclohexylethyl]acetamide
CID 13617461
3-methoxy-N-[(2R)-octan-2-yl]propanamide
CID 53496020
3-methoxy-N-[(2R)-6-methylheptan-2-yl]propanamide
CID 53496021
N-[(2R)-heptan-2-yl]-3-methoxypropanamide
CID 166437538

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide?
The IUPAC name of N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide (CID 166437638) is N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide.
What is the SMILES notation for N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide?
The canonical SMILES for N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide is COCCC(=O)N[C@H](C)C1CCCCC1.
What is the InChIKey of N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide?
The InChIKey is GJMQFCKYGSZJFY-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10(11-6-4-3-5-7-11)13-12(14)8-9-15-2/h10-11H,3-9H2,1-2H3,(H,13,14)/t10-/m1/s1.
What are the key properties of N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide?
N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide has a molecular weight of 213.32 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclohexylethyl]-3-methoxypropanamide is sourced from PubChem (CID 166437638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).