3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide

C12H26N2O3 — CID 106112070

IUPAC3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(CCOC)C(=O)C(CN)OC
InChIInChI=1S/C12H26N2O3/c1-5-10(6-2)14(7-8-16-3)12(15)11(9-13)17-4/h10-11H,5-9,13H2,1-4H3
InChIKeyOCVKMKXZJXTWOR-UHFFFAOYSA-N
MW246.35 g/mol
LogP0.62
Rot. Bonds9

About 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide

3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide (PubChem CID 106112070) has the molecular formula C12H26N2O3 and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide.

Molecular Properties

Compound Name3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
PubChem CID106112070
Molecular FormulaC12H26N2O3
Molecular Weight246.35 g/mol
Exact Mass246.19
IUPAC Name3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(CCOC)C(=O)C(CN)OC
InChIInChI=1S/C12H26N2O3/c1-5-10(6-2)14(7-8-16-3)12(15)11(9-13)17-4/h10-11H,5-9,13H2,1-4H3
InChIKeyOCVKMKXZJXTWOR-UHFFFAOYSA-N
XLogP0.62
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide 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-bromo-N-(2-methoxyethyl)-N-pentan-3-ylbutanamide
CID 62855963
4-amino-N-(2-methoxyethyl)-2-methyl-N-pentan-3-ylbutanamide
CID 80542973
3-amino-N-cyclopropyl-2-methoxy-N-(2-methoxyethyl)propanamide
CID 106112093
N-(2-methoxyethyl)-2-methyl-3-(methylamino)-N-pentan-3-ylpropanamide;hydrochloride
CID 119729632
3-amino-N-butan-2-yl-N-butyl-2-methoxypropanamide
CID 106112047
2-(2-aminoethoxy)-N-(2-methoxyethyl)-N-pentan-3-ylacetamide
CID 79474034
(2R)-2-amino-N-(2-methoxyethyl)-4-methylsulfanyl-N-pentan-3-ylbutanamide
CID 104907756
3-amino-N-(2-cyanoethyl)-2-methoxy-N-(2-methoxyethyl)propanamide
CID 106112850
(2S)-2-amino-N-(2-methoxyethyl)-N-pentan-3-yl-3-phenylpropanamide
CID 61163372
3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide
CID 106113210
(2R)-2-amino-N-(2-methoxyethyl)-N-propan-2-ylbutanamide
CID 82949069
ethyl 2-[(3-amino-2-methoxypropanoyl)-propan-2-ylamino]acetate
CID 106112261

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
The IUPAC name of 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide (CID 106112070) is 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide.
What is the SMILES notation for 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
The canonical SMILES for 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide is CCC(CC)N(CCOC)C(=O)C(CN)OC.
What is the InChIKey of 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
The InChIKey is OCVKMKXZJXTWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3/c1-5-10(6-2)14(7-8-16-3)12(15)11(9-13)17-4/h10-11H,5-9,13H2,1-4H3.
What are the key properties of 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide has a molecular weight of 246.35 g/mol, XLogP of 0.62, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide is sourced from PubChem (CID 106112070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).