2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide

C14H27N3O2 — CID 64684379

IUPAC2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide
SMILESCC(C)(C)NC(=O)CNC(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H27N3O2/c1-13(2,3)17-12(19)10-16-11(18)9-14(15)7-5-4-6-8-14/h4-10,15H2,1-3H3,(H,16,18)(H,17,19)
InChIKeyUUWHRKIHFJWVSQ-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.07
Rot. Bonds4

About 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide

2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide (PubChem CID 64684379) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide
PubChem CID64684379
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide
SMILESCC(C)(C)NC(=O)CNC(=O)CC1(N)CCCCC1
InChIInChI=1S/C14H27N3O2/c1-13(2,3)17-12(19)10-16-11(18)9-14(15)7-5-4-6-8-14/h4-10,15H2,1-3H3,(H,16,18)(H,17,19)
InChIKeyUUWHRKIHFJWVSQ-UHFFFAOYSA-N
XLogP1.07
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclopentyl)-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 64686159
1-amino-N-[2-(tert-butylamino)-2-oxoethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119272923
2-(1-aminocyclohexyl)-N-(2-amino-2-oxoethyl)acetamide
CID 64684917
2-(1-aminocyclohexyl)-N-(2-methoxy-2-methylpropyl)acetamide
CID 113450228
2-(1-aminocyclopentyl)-N-(2-methyl-2-methylsulfonylpropyl)acetamide
CID 79551122
3-[[2-(1-aminocyclohexyl)acetyl]amino]-N,2,2-trimethylpropanamide
CID 106276956
2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]-N-methylacetamide
CID 64685095
2-(1-aminocyclopentyl)-N-[2-(dimethylamino)-2-oxoethyl]acetamide
CID 64686359
2-(1-aminocyclobutyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 112701652
2-[[2-(1-aminocyclobutyl)acetyl]amino]acetic acid
CID 79854186
2-(1-aminocyclopentyl)-N-(2-ethyl-2-hydroxybutyl)acetamide
CID 65106412
2-(1-aminocyclohexyl)-N-[2-ethyl-2-(hydroxymethyl)butyl]acetamide
CID 106255433

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide (CID 64684379) is 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide is CC(C)(C)NC(=O)CNC(=O)CC1(N)CCCCC1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide?
The InChIKey is UUWHRKIHFJWVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-13(2,3)17-12(19)10-16-11(18)9-14(15)7-5-4-6-8-14/h4-10,15H2,1-3H3,(H,16,18)(H,17,19).
What are the key properties of 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide?
2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide has a molecular weight of 269.39 g/mol, XLogP of 1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-[2-(tert-butylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 64684379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).