2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide

C12H27N3O2 — CID 113468478

IUPAC2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide
SMILESCOCCN(CCN)C(C)C(=O)NC(C)(C)C
InChIInChI=1S/C12H27N3O2/c1-10(11(16)14-12(2,3)4)15(7-6-13)8-9-17-5/h10H,6-9,13H2,1-5H3,(H,14,16)
InChIKeyRLWWOHBDRWPGBN-UHFFFAOYSA-N
MW245.37 g/mol
LogP0.20
Rot. Bonds7

About 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide

2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide (PubChem CID 113468478) has the molecular formula C12H27N3O2 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide.

Molecular Properties

Compound Name2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide
PubChem CID113468478
Molecular FormulaC12H27N3O2
Molecular Weight245.37 g/mol
Exact Mass245.21
IUPAC Name2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide
SMILESCOCCN(CCN)C(C)C(=O)NC(C)(C)C
InChIInChI=1S/C12H27N3O2/c1-10(11(16)14-12(2,3)4)15(7-6-13)8-9-17-5/h10H,6-9,13H2,1-5H3,(H,14,16)
InChIKeyRLWWOHBDRWPGBN-UHFFFAOYSA-N
XLogP0.20
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-aminoethyl(methyl)amino]-N-tert-butylpropanamide
CID 61348533
2-[bis(2-hydroxyethyl)amino]-N-tert-butylpropanamide
CID 60686797
2-[2-aminoethyl(ethyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350485
2-[3-aminopropyl(2-methoxyethyl)amino]-N-(2-methylpropyl)propanamide
CID 55171324
2-[3-aminopropyl(methyl)amino]-N-tert-butylpropanamide
CID 43116493
2-[(2-amino-3-methoxypropyl)-methylamino]-N-tert-butylpropanamide
CID 63761507
2-[[1-(tert-butylamino)-1-oxopropan-2-yl]-(carboxymethyl)amino]acetic acid
CID 63645143
4-amino-N-tert-butyl-3-[2-methoxyethyl(propan-2-yl)amino]butanamide
CID 82948851
(2S)-2-amino-N-tert-butyl-3-methoxypropanamide
CID 164800240
2-[2-aminoethyl(propyl)amino]-N-propylpropanamide
CID 61349368
N-tert-butyl-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]propanamide
CID 79389363
methyl 2-[[1-(tert-butylamino)-1-oxopropan-2-yl]-methylamino]acetate
CID 60677092

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide?
The IUPAC name of 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide (CID 113468478) is 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide.
What is the SMILES notation for 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide?
The canonical SMILES for 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide is COCCN(CCN)C(C)C(=O)NC(C)(C)C.
What is the InChIKey of 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide?
The InChIKey is RLWWOHBDRWPGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2/c1-10(11(16)14-12(2,3)4)15(7-6-13)8-9-17-5/h10H,6-9,13H2,1-5H3,(H,14,16).
What are the key properties of 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide?
2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide has a molecular weight of 245.37 g/mol, XLogP of 0.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethyl(2-methoxyethyl)amino]-N-tert-butylpropanamide is sourced from PubChem (CID 113468478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).