N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide

C11H25N3O3 — CID 61244464

IUPACN-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide
SMILESCN(CCCN)C(=O)CCN(CCO)CCO
InChIInChI=1S/C11H25N3O3/c1-13(5-2-4-12)11(17)3-6-14(7-9-15)8-10-16/h15-16H,2-10,12H2,1H3
InChIKeyBMRJYMDVFULDET-UHFFFAOYSA-N
MW247.34 g/mol
LogP-1.53
Rot. Bonds10

About N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide

N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide (PubChem CID 61244464) has the molecular formula C11H25N3O3 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide
PubChem CID61244464
Molecular FormulaC11H25N3O3
Molecular Weight247.34 g/mol
Exact Mass247.19
IUPAC NameN-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide
SMILESCN(CCCN)C(=O)CCN(CCO)CCO
InChIInChI=1S/C11H25N3O3/c1-13(5-2-4-12)11(17)3-6-14(7-9-15)8-10-16/h15-16H,2-10,12H2,1H3
InChIKeyBMRJYMDVFULDET-UHFFFAOYSA-N
XLogP-1.53
TPSA90.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 5-1.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

7-amino-N-(5-hydroxypentyl)-N-methylheptanamide
CID 107199281
N-(3-aminopropyl)-3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]-N-methylpropanamide
CID 43588549
N-(3-aminopropyl)-3-[ethyl(2-ethylbutyl)amino]-N-methylpropanamide
CID 43588424
2-[bis(3-aminopropyl)amino]ethanol
CID 19359070
N-(3-aminopropyl)-N-methyloctanamide
CID 43125160
3-bromo-N-(5-hydroxypentyl)-N-methylpropanamide
CID 107198834
N-(3-aminopropyl)-N-methylheptanamide
CID 115737512
N-(3-aminopropyl)-N-methyldecanamide
CID 65447774
N-(5-aminopentyl)-4,4,4-trifluoro-N-methylbutanamide
CID 107206525
8-[2-hydroxyethyl(8-octylhexadecyl)amino]-N-methyl-N-nonyloctanamide
CID 170755316
N-(5-aminopentyl)-3-ethoxy-N-methylpropanamide
CID 107206617
5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
CID 139993140

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide?
The IUPAC name of N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide (CID 61244464) is N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide.
What is the SMILES notation for N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide?
The canonical SMILES for N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide is CN(CCCN)C(=O)CCN(CCO)CCO.
What is the InChIKey of N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide?
The InChIKey is BMRJYMDVFULDET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O3/c1-13(5-2-4-12)11(17)3-6-14(7-9-15)8-10-16/h15-16H,2-10,12H2,1H3.
What are the key properties of N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide?
N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide has a molecular weight of 247.34 g/mol, XLogP of -1.53, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-3-[bis(2-hydroxyethyl)amino]-N-methylpropanamide is sourced from PubChem (CID 61244464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).