4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide

C17H34N2O2 — CID 64719823

IUPAC4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CC(C)OC1CCCC(CC)C1)C(N)=O
InChIInChI=1S/C17H34N2O2/c1-5-10-19-17(4,16(18)20)12-13(3)21-15-9-7-8-14(6-2)11-15/h13-15,19H,5-12H2,1-4H3,(H2,18,20)
InChIKeyLEGUEJBILGCHRX-UHFFFAOYSA-N
MW298.47 g/mol
LogP2.99
Rot. Bonds9

About 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide

4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide (PubChem CID 64719823) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide.

Molecular Properties

Compound Name4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide
PubChem CID64719823
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CC(C)OC1CCCC(CC)C1)C(N)=O
InChIInChI=1S/C17H34N2O2/c1-5-10-19-17(4,16(18)20)12-13(3)21-15-9-7-8-14(6-2)11-15/h13-15,19H,5-12H2,1-4H3,(H2,18,20)
InChIKeyLEGUEJBILGCHRX-UHFFFAOYSA-N
XLogP2.99
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-(methylamino)-4-(3-methylcyclohexyl)oxypentanamide
CID 64707548
2-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(propylamino)pentanamide
CID 64709010
4-(2-cyclobutylethoxy)-2-methyl-2-(propylamino)pentanoic acid
CID 106204642
4-(3-ethylcyclohexyl)oxy-N-propylpentan-2-amine
CID 64719133
4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 64727643
ethyl 2-(ethylamino)-2-methyl-4-(3-methylcyclohexyl)oxypentanoate
CID 64707958
3-(cyclohexylmethoxy)-2-methyl-2-(propylamino)propanamide
CID 55066159
4-[cyclopropylmethyl(ethyl)amino]-2-methyl-2-(propylamino)pentanamide
CID 64705483
4-(2-ethylazepan-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 104691662
ethyl 4-cyclobutyloxy-2-methyl-2-(methylamino)pentanoate
CID 64721136
trans-(1S,3S)-1-ethyl-3-propan-2-yloxycyclohexane
CID 177191810
4-(3-methoxy-3-methylbutoxy)-2-methyl-2-(propylamino)pentanamide
CID 106666691

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide?
The IUPAC name of 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide (CID 64719823) is 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide.
What is the SMILES notation for 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide?
The canonical SMILES for 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide is CCCNC(C)(CC(C)OC1CCCC(CC)C1)C(N)=O.
What is the InChIKey of 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide?
The InChIKey is LEGUEJBILGCHRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-5-10-19-17(4,16(18)20)12-13(3)21-15-9-7-8-14(6-2)11-15/h13-15,19H,5-12H2,1-4H3,(H2,18,20).
What are the key properties of 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide?
4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide has a molecular weight of 298.47 g/mol, XLogP of 2.99, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide is sourced from PubChem (CID 64719823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).