N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide

C16H30N2O2 — CID 99614050

IUPACN-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide
SMILESC[C@@H]1CCCC[C@H]1NC(=O)CN(C)C[C@@H]1CCCCO1
InChIInChI=1S/C16H30N2O2/c1-13-7-3-4-9-15(13)17-16(19)12-18(2)11-14-8-5-6-10-20-14/h13-15H,3-12H2,1-2H3,(H,17,19)/t13-,14+,15-/m1/s1
InChIKeyNWGSXMPPJXIZOK-QLFBSQMISA-N
MW282.43 g/mol
LogP2.18
Rot. Bonds5

About N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide

N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide (PubChem CID 99614050) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide
PubChem CID99614050
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide
SMILESC[C@@H]1CCCC[C@H]1NC(=O)CN(C)C[C@@H]1CCCCO1
InChIInChI=1S/C16H30N2O2/c1-13-7-3-4-9-15(13)17-16(19)12-18(2)11-14-8-5-6-10-20-14/h13-15H,3-12H2,1-2H3,(H,17,19)/t13-,14+,15-/m1/s1
InChIKeyNWGSXMPPJXIZOK-QLFBSQMISA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide with MolForge

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Related Compounds

N-(4-methylcyclohexyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825193
N-(1-ethylpiperidin-4-yl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86826056
2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methylamino]-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 124738895
N-(2-methylbutan-2-yl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825153
2-[[1-(2-hydroxyethyl)piperidin-4-yl]methyl-methylamino]-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CID 95345385
N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl(prop-2-ynyl)amino]acetamide
CID 124623956
N'-methyl-N-(2-methylcyclohexyl)-N'-(oxolan-2-ylmethyl)ethane-1,2-diamine
CID 62554913
2-[cyclopropylmethyl-[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]amino]acetic acid
CID 43656905
2-[methyl(oxan-2-ylmethyl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 86825120
N-[(1S,2S)-2-methylcyclohexyl]-2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 11939314
methyl 3-[methyl(oxan-2-ylmethyl)amino]propanoate
CID 61233938
2-methyl-N-(oxan-2-ylmethyl)cyclopentan-1-amine
CID 63278391

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide?
The IUPAC name of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide (CID 99614050) is N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide.
What is the SMILES notation for N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide?
The canonical SMILES for N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide is C[C@@H]1CCCC[C@H]1NC(=O)CN(C)C[C@@H]1CCCCO1.
What is the InChIKey of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide?
The InChIKey is NWGSXMPPJXIZOK-QLFBSQMISA-N. The full InChI is InChI=1S/C16H30N2O2/c1-13-7-3-4-9-15(13)17-16(19)12-18(2)11-14-8-5-6-10-20-14/h13-15H,3-12H2,1-2H3,(H,17,19)/t13-,14+,15-/m1/s1.
What are the key properties of N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide?
N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide has a molecular weight of 282.43 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-methylcyclohexyl]-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide is sourced from PubChem (CID 99614050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).