N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide

C11H22N2O2 — CID 65152557

IUPACN-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide
SMILESCN(CCCN)C(=O)CCC1CCCO1
InChIInChI=1S/C11H22N2O2/c1-13(8-3-7-12)11(14)6-5-10-4-2-9-15-10/h10H,2-9,12H2,1H3
InChIKeyLFDARLXQZAYFPV-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.75
Rot. Bonds6

About N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide

N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide (PubChem CID 65152557) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide
PubChem CID65152557
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide
SMILESCN(CCCN)C(=O)CCC1CCCO1
InChIInChI=1S/C11H22N2O2/c1-13(8-3-7-12)11(14)6-5-10-4-2-9-15-10/h10H,2-9,12H2,1H3
InChIKeyLFDARLXQZAYFPV-UHFFFAOYSA-N
XLogP0.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N-methyl-3-(oxolan-2-yl)propanamide
CID 86929613
N-(2-hydroxyethyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 60749979
N-(3-aminopropyl)-N-cyclohexyl-3-(oxolan-2-yl)propanamide
CID 65152218
N-(3-aminopropyl)-3-[ethyl(oxolan-2-ylmethyl)amino]-N-methylpropanamide
CID 61433794
methyl 3-[methyl-[3-(oxolan-2-yl)propanoyl]amino]propanoate
CID 54979906
N-(3-aminopropyl)-N-methyl-3-(oxan-2-ylmethoxy)propanamide
CID 43254238
N-(2-aminoethyl)-N-cyclobutyl-3-(oxolan-2-yl)propanamide
CID 102874215
N-(3-aminopropyl)-N-methyl-2-(oxan-2-ylmethoxy)acetamide
CID 43254240
5-[methyl-[2-[(2S)-oxan-2-yl]ethyl]amino]-5-oxopentanoic acid
CID 126440241
N-(2-aminoethyl)-N-cyclopropyl-3-(oxan-2-yl)propanamide
CID 63952702
tert-butyl 2-[methyl-[3-[(2R)-oxolan-2-yl]propanoyl]amino]acetate
CID 100668130
N-[[3-(aminomethyl)phenyl]methyl]-N-methyl-3-(oxolan-2-yl)propanamide
CID 65152460

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide?
The IUPAC name of N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide (CID 65152557) is N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide?
The canonical SMILES for N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide is CN(CCCN)C(=O)CCC1CCCO1.
What is the InChIKey of N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide?
The InChIKey is LFDARLXQZAYFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-13(8-3-7-12)11(14)6-5-10-4-2-9-15-10/h10H,2-9,12H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide?
N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide has a molecular weight of 214.31 g/mol, XLogP of 0.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide is sourced from PubChem (CID 65152557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).