2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide

C14H29N3O2 — CID 114782492

IUPAC2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN1CC(CN)OC(C)(C)C1
InChIInChI=1S/C14H29N3O2/c1-11(2)5-6-16-13(18)9-17-8-12(7-15)19-14(3,4)10-17/h11-12H,5-10,15H2,1-4H3,(H,16,18)
InChIKeyYAGHDASTIRIWIS-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.59
Rot. Bonds6

About 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide

2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide (PubChem CID 114782492) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide
PubChem CID114782492
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN1CC(CN)OC(C)(C)C1
InChIInChI=1S/C14H29N3O2/c1-11(2)5-6-16-13(18)9-17-8-12(7-15)19-14(3,4)10-17/h11-12H,5-10,15H2,1-4H3,(H,16,18)
InChIKeyYAGHDASTIRIWIS-UHFFFAOYSA-N
XLogP0.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-butan-2-ylacetamide
CID 114782398
2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-propylpropanamide
CID 114782484
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 114777452
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide
CID 114779554
2-[4,7-bis(carboxymethyl)-10-[2-(3-methylbutylamino)-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 144632166
2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 114782402
[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-(2-methylcyclopropyl)methanone
CID 114782099
2-[2-(aminomethyl)morpholin-4-yl]-N-propylacetamide
CID 61336633
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 114779811
[6,6-dimethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]morpholin-2-yl]methanamine
CID 114782508
N-(2-oxo-2-pyrrolidin-1-ylethyl)-2-(2,2,6-trimethylmorpholin-4-yl)acetamide
CID 48633104
1-[2-(3-methylbutylamino)-2-oxoethyl]-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 63710888

Frequently Asked Questions

What is the IUPAC name of 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide?
The IUPAC name of 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide (CID 114782492) is 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide.
What is the SMILES notation for 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide?
The canonical SMILES for 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide is CC(C)CCNC(=O)CN1CC(CN)OC(C)(C)C1.
What is the InChIKey of 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide?
The InChIKey is YAGHDASTIRIWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-11(2)5-6-16-13(18)9-17-8-12(7-15)19-14(3,4)10-17/h11-12H,5-10,15H2,1-4H3,(H,16,18).
What are the key properties of 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide?
2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide has a molecular weight of 271.40 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 114782492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).