6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide

C14H28N2O2 — CID 114112929

IUPAC6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide
SMILESCOCCC1(CNC(=O)CCC(C)CCN)CC1
InChIInChI=1S/C14H28N2O2/c1-12(5-9-15)3-4-13(17)16-11-14(6-7-14)8-10-18-2/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeyXVCMHISTTJMQOE-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.68
Rot. Bonds10

About 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide

6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide (PubChem CID 114112929) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide.

Molecular Properties

Compound Name6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide
PubChem CID114112929
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide
SMILESCOCCC1(CNC(=O)CCC(C)CCN)CC1
InChIInChI=1S/C14H28N2O2/c1-12(5-9-15)3-4-13(17)16-11-14(6-7-14)8-10-18-2/h12H,3-11,15H2,1-2H3,(H,16,17)
InChIKeyXVCMHISTTJMQOE-UHFFFAOYSA-N
XLogP1.68
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[[1-(2-methoxyethyl)cyclopentyl]methyl]butanamide;hydrochloride
CID 119339921
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-propan-2-yloxyacetamide
CID 103800058
1-[[(6-amino-4-methylhexanoyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115433630
3-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]butanamide
CID 119820393
6-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-4-methylhexanamide
CID 83110420
2-methoxy-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]propanamide
CID 103799994
6-amino-4-ethyl-N-[[1-(hydroxymethyl)cyclopropyl]methyl]hexanamide
CID 113313291
2-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylpentanamide
CID 103950711
6-amino-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-4-methylhexanamide
CID 65119052
2-(tert-butylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
CID 113264722
(2S)-2-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]hexanamide
CID 113357272
6-amino-N-[(1-hydroxy-4-methylcyclohexyl)methyl]-4-methylhexanamide
CID 65120023

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide?
The IUPAC name of 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide (CID 114112929) is 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide.
What is the SMILES notation for 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide?
The canonical SMILES for 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide is COCCC1(CNC(=O)CCC(C)CCN)CC1.
What is the InChIKey of 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide?
The InChIKey is XVCMHISTTJMQOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-12(5-9-15)3-4-13(17)16-11-14(6-7-14)8-10-18-2/h12H,3-11,15H2,1-2H3,(H,16,17).
What are the key properties of 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide?
6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide has a molecular weight of 256.39 g/mol, XLogP of 1.68, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-4-methylhexanamide is sourced from PubChem (CID 114112929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).