3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide

C12H24N2O2 — CID 106274861

IUPAC3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
SMILESCOC1CCCCC1NCC(C)(C)C(N)=O
InChIInChI=1S/C12H24N2O2/c1-12(2,11(13)15)8-14-9-6-4-5-7-10(9)16-3/h9-10,14H,4-8H2,1-3H3,(H2,13,15)
InChIKeyLESQEWVNVFKIAY-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.05
Rot. Bonds5

About 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide

3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide (PubChem CID 106274861) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
PubChem CID106274861
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
SMILESCOC1CCCCC1NCC(C)(C)C(N)=O
InChIInChI=1S/C12H24N2O2/c1-12(2,11(13)15)8-14-9-6-4-5-7-10(9)16-3/h9-10,14H,4-8H2,1-3H3,(H2,13,15)
InChIKeyLESQEWVNVFKIAY-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1S,2S)-2-methoxycyclohexyl]amino]acetamide
CID 93280771
2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
CID 43755109
3-(cyclopentylamino)-2,2-dimethylpropanamide
CID 103617377
ethyl 2-[(2-methoxycyclohexyl)amino]acetate
CID 60810510
2-[[(1R,2R)-2-methoxycyclohexyl]amino]acetic acid
CID 93286937
3-[(4-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
CID 104530552
N'-(2-methoxycyclohexyl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 43758942
trans-(1S,2S)-N-ethyl-2-methoxycyclohexan-1-amine
CID 93280859
2-[(2-methoxycyclohexyl)amino]-N,N-dimethylacetamide
CID 43775418
methyl 3-[[2-(hydroxymethyl)cyclopentyl]amino]-2,2-dimethylpropanoate
CID 106360580
N-(cyclopropylmethyl)-2-methoxycyclohexan-1-amine
CID 43756809
3-[(4-hydroxyoxolan-3-yl)amino]-2,2-dimethylpropanamide
CID 106276490

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide (CID 106274861) is 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide is COC1CCCCC1NCC(C)(C)C(N)=O.
What is the InChIKey of 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide?
The InChIKey is LESQEWVNVFKIAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2,11(13)15)8-14-9-6-4-5-7-10(9)16-3/h9-10,14H,4-8H2,1-3H3,(H2,13,15).
What are the key properties of 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide?
3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide has a molecular weight of 228.34 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 106274861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).