2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide

C16H30N2O2 — CID 64744615

IUPAC2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide
SMILESCC1CCC(OCCC(C)(NC2CC2)C(N)=O)CC1C
InChIInChI=1S/C16H30N2O2/c1-11-4-7-14(10-12(11)2)20-9-8-16(3,15(17)19)18-13-5-6-13/h11-14,18H,4-10H2,1-3H3,(H2,17,19)
InChIKeyRRNGSIVYFZMVET-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.21
Rot. Bonds7

About 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide

2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide (PubChem CID 64744615) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide
PubChem CID64744615
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide
SMILESCC1CCC(OCCC(C)(NC2CC2)C(N)=O)CC1C
InChIInChI=1S/C16H30N2O2/c1-11-4-7-14(10-12(11)2)20-9-8-16(3,15(17)19)18-13-5-6-13/h11-14,18H,4-10H2,1-3H3,(H2,17,19)
InChIKeyRRNGSIVYFZMVET-UHFFFAOYSA-N
XLogP2.21
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3,4-dimethylcyclohexyl)oxy-2-(ethylamino)-2-methylhexanamide
CID 64746944
methyl 2-amino-5-(3,4-dimethylcyclohexyl)oxy-2-methylpentanoate
CID 64745594
ethyl 4-cyclobutyloxy-2-(cyclopropylamino)-2-methylbutanoate
CID 62142000
2-(cyclopropylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutanamide
CID 102722876
methyl 2-(cyclopropylamino)-3-(3,4-dimethylcyclohexyl)oxypropanoate
CID 64744611
2-(cyclopropylamino)-4-(3,4-dimethylpyrrolidin-1-yl)-2-methylbutanamide
CID 79184111
methyl 5-(3,4-dimethylcyclohexyl)oxy-2-methyl-2-(methylamino)pentanoate
CID 64746965
2-(cyclopropylamino)-2-methyl-6-(2-propoxyethoxy)hexanamide
CID 63685314
2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylpentanoic acid
CID 64746960
2-(cyclopropylamino)-4-(3-ethoxyphenoxy)-2-methylbutanamide
CID 62337489
2-(cyclopropylamino)-5-[2-methoxyethyl(propan-2-yl)amino]-2-methylpentanamide
CID 82960589
6-(3,4-dimethylcyclohexyl)oxy-2,2-dimethylhexanimidamide
CID 106712451

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide?
The IUPAC name of 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide (CID 64744615) is 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide is CC1CCC(OCCC(C)(NC2CC2)C(N)=O)CC1C.
What is the InChIKey of 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide?
The InChIKey is RRNGSIVYFZMVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-11-4-7-14(10-12(11)2)20-9-8-16(3,15(17)19)18-13-5-6-13/h11-14,18H,4-10H2,1-3H3,(H2,17,19).
What are the key properties of 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide?
2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide has a molecular weight of 282.43 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-(3,4-dimethylcyclohexyl)oxy-2-methylbutanamide is sourced from PubChem (CID 64744615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).