2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide

C15H30N2O — CID 78966290

IUPAC2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide
SMILESCC1CCCC(CCNC(=O)CNC(C)(C)C)C1
InChIInChI=1S/C15H30N2O/c1-12-6-5-7-13(10-12)8-9-16-14(18)11-17-15(2,3)4/h12-13,17H,5-11H2,1-4H3,(H,16,18)
InChIKeyHYZYEMBTRIYFAC-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds5

About 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide

2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide (PubChem CID 78966290) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide
PubChem CID78966290
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide
SMILESCC1CCCC(CCNC(=O)CNC(C)(C)C)C1
InChIInChI=1S/C15H30N2O/c1-12-6-5-7-13(10-12)8-9-16-14(18)11-17-15(2,3)4/h12-13,17H,5-11H2,1-4H3,(H,16,18)
InChIKeyHYZYEMBTRIYFAC-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide;hydrochloride
CID 119783122
2-hydroxy-2-methyl-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 103430075
(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 78966012
1-methoxy-3-[2-[(1S,3S)-3-methylcyclohexyl]ethyl]urea
CID 95628739
2-cyano-2-methyl-N-[2-(3-methylcyclohexyl)ethyl]butanamide
CID 113270371
3-bromo-N-[2-(3-methylcyclohexyl)ethyl]prop-2-ynamide
CID 130918142
2-(tert-butylamino)-1-(3-methylcyclohexyl)ethanone
CID 116588854
N-[2-(ethylamino)ethyl]-2-(3-methylcyclohexyl)acetamide
CID 119507538
(2S)-2-amino-3-methyl-N-[2-(3-methylcyclohexyl)ethyl]butanamide;hydrochloride
CID 119323315
3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide
CID 115629689
N-(2-cyclobutylethyl)-2-(cyclopropylmethylamino)acetamide
CID 115739981
3-[[2-(tert-butylamino)acetyl]amino]-N-cyclopropylpropanamide
CID 79400913

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide?
The IUPAC name of 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide (CID 78966290) is 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide is CC1CCCC(CCNC(=O)CNC(C)(C)C)C1.
What is the InChIKey of 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide?
The InChIKey is HYZYEMBTRIYFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12-6-5-7-13(10-12)8-9-16-14(18)11-17-15(2,3)4/h12-13,17H,5-11H2,1-4H3,(H,16,18).
What are the key properties of 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide?
2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-[2-(3-methylcyclohexyl)ethyl]acetamide is sourced from PubChem (CID 78966290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).