2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide

C12H27N3O3 — CID 81089239

IUPAC2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide
SMILESCOCCN(CCCN(C)C)C(=O)C(N)COC
InChIInChI=1S/C12H27N3O3/c1-14(2)6-5-7-15(8-9-17-3)12(16)11(13)10-18-4/h11H,5-10,13H2,1-4H3
InChIKeyCNBDFMMUZCUISK-UHFFFAOYSA-N
MW261.37 g/mol
LogP-0.61
Rot. Bonds10

About 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide

2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide (PubChem CID 81089239) has the molecular formula C12H27N3O3 and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide
PubChem CID81089239
Molecular FormulaC12H27N3O3
Molecular Weight261.37 g/mol
Exact Mass261.21
IUPAC Name2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide
SMILESCOCCN(CCCN(C)C)C(=O)C(N)COC
InChIInChI=1S/C12H27N3O3/c1-14(2)6-5-7-15(8-9-17-3)12(16)11(13)10-18-4/h11H,5-10,13H2,1-4H3
InChIKeyCNBDFMMUZCUISK-UHFFFAOYSA-N
XLogP-0.61
TPSA68.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)butanediamide
CID 54874249
2-amino-N,N-dibutyl-3-methoxypropanamide
CID 81081055
2-amino-N-(2-cyanoethyl)-3-methoxy-N-(2-methoxyethyl)propanamide
CID 81088238
2-amino-N-butyl-N-ethyl-3-methoxypropanamide
CID 81081138
3-amino-4-[bis[3-(dimethylamino)propyl]amino]-4-oxobutanoic acid
CID 64896902
3-[3-(dimethylamino)propyl-(2-methoxyethyl)amino]-3-oxopropanoic acid
CID 62229917
4-[3-(dimethylamino)propyl-(2-methoxyethyl)amino]-4-oxobutanoic acid
CID 54876287
3-amino-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)-2,2-dimethylpropanamide
CID 113307599
2-chloro-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)-2-phenylacetamide
CID 60949486
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-ethylbutanamide
CID 102992755
2-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)-3-phenylpropanamide
CID 60980750
(2R)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)pentanamide
CID 107570616

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide (CID 81089239) is 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide is COCCN(CCCN(C)C)C(=O)C(N)COC.
What is the InChIKey of 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide?
The InChIKey is CNBDFMMUZCUISK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O3/c1-14(2)6-5-7-15(8-9-17-3)12(16)11(13)10-18-4/h11H,5-10,13H2,1-4H3.
What are the key properties of 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide?
2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide has a molecular weight of 261.37 g/mol, XLogP of -0.61, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(dimethylamino)propyl]-3-methoxy-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 81089239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).