N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide

C14H28N2O2 — CID 39973439

IUPACN-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide
SMILESCOC[C@H](C)NC(=O)CN(C)C1CCC(C)CC1
InChIInChI=1S/C14H28N2O2/c1-11-5-7-13(8-6-11)16(3)9-14(17)15-12(2)10-18-4/h11-13H,5-10H2,1-4H3,(H,15,17)/t11?,12-,13?/m0/s1
InChIKeyUHDXTCZTISJBRT-CPCZMJQVSA-N
MW256.39 g/mol
LogP1.65
Rot. Bonds6

About N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide

N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide (PubChem CID 39973439) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide
PubChem CID39973439
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide
SMILESCOC[C@H](C)NC(=O)CN(C)C1CCC(C)CC1
InChIInChI=1S/C14H28N2O2/c1-11-5-7-13(8-6-11)16(3)9-14(17)15-12(2)10-18-4/h11-13H,5-10H2,1-4H3,(H,15,17)/t11?,12-,13?/m0/s1
InChIKeyUHDXTCZTISJBRT-CPCZMJQVSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclopropyl-[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]amino]propanoic acid
CID 54925563
4-[[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]-methylamino]oxolane-3-carboxylic acid
CID 66235786
3-methyl-1-[methyl-(4-methylcyclohexyl)amino]butan-2-one
CID 79396284
2-[(4-hydroxycyclohexyl)-methylamino]-N-propan-2-ylacetamide
CID 114762510
N-[(1S)-1-(2-chlorophenyl)ethyl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 39973443
2-[2-hydroxyethyl(methyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 60683894
N-cyclopropyl-2-[methyl-(4-methylcyclohexyl)amino]-N-(2-methylpropyl)acetamide
CID 78896010
2-[methyl-(4-methylcyclohexyl)amino]acetic acid
CID 60712035
N-(2-aminoethyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 61438988
methyl 3-[[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]-methylamino]propanoate
CID 62011672
N-butan-2-yl-2-[methyl-(4-oxocyclohexyl)amino]acetamide
CID 79120506
2-[(2-hydroxycyclohexyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 62360031

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
The IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide (CID 39973439) is N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
The canonical SMILES for N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide is COC[C@H](C)NC(=O)CN(C)C1CCC(C)CC1.
What is the InChIKey of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
The InChIKey is UHDXTCZTISJBRT-CPCZMJQVSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11-5-7-13(8-6-11)16(3)9-14(17)15-12(2)10-18-4/h11-13H,5-10H2,1-4H3,(H,15,17)/t11?,12-,13?/m0/s1.
What are the key properties of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide?
N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide has a molecular weight of 256.39 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-methoxypropan-2-yl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide is sourced from PubChem (CID 39973439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).