N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide

C12H23NO2 — CID 112685953

IUPACN-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide
SMILESCOC(C)C(=O)N(C)CC1CCCCC1
InChIInChI=1S/C12H23NO2/c1-10(15-3)12(14)13(2)9-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3
InChIKeyMHCMTVTXJFXDGX-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.06
Rot. Bonds4

About N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide

N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide (PubChem CID 112685953) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide
PubChem CID112685953
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide
SMILESCOC(C)C(=O)N(C)CC1CCCCC1
InChIInChI=1S/C12H23NO2/c1-10(15-3)12(14)13(2)9-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3
InChIKeyMHCMTVTXJFXDGX-UHFFFAOYSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-methyl-N-(oxan-3-ylmethyl)propanamide
CID 115618168
(2S,3S)-2-amino-N-(cyclohexylmethyl)-N,3-dimethylpentanamide
CID 61162838
4-[cyclopentylmethyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498428
2-amino-N-(cyclohexylmethyl)-N,3-dimethylbutanamide;hydrochloride
CID 119279206
N-(cyclobutylmethyl)-N-methyl-2-(methylamino)propanamide
CID 62861176
cycloheptylmethyl(methyl)carbamic acid
CID 146255648
2-amino-N-(cyclopentylmethyl)-N,4-dimethylpentanamide
CID 63654905
2-amino-N-(cyclopentylmethyl)-4-methoxy-N-methylbutanamide
CID 63654910
2-amino-N-(cyclobutylmethyl)-N,3-dimethylpentanamide
CID 62862218
(2S)-2-amino-N-(cyclohexylmethyl)-N-methylpentanamide
CID 107568999
2-(cycloheptylmethylamino)-N-ethyl-N-methylpropanamide
CID 103107981
(2S)-2-amino-N-(cyclohexylmethyl)-N,3,3-trimethylbutanamide;hydrochloride
CID 119704436

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide?
The IUPAC name of N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide (CID 112685953) is N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide is COC(C)C(=O)N(C)CC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide?
The InChIKey is MHCMTVTXJFXDGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10(15-3)12(14)13(2)9-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3.
What are the key properties of N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide?
N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-methoxy-N-methylpropanamide is sourced from PubChem (CID 112685953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).