1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone

C15H29N3O2 — CID 106614579

IUPAC1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone
SMILESCC1CN(C(=O)CN(CC2CCCN2)C(C)C)CCO1
InChIInChI=1S/C15H29N3O2/c1-12(2)18(10-14-5-4-6-16-14)11-15(19)17-7-8-20-13(3)9-17/h12-14,16H,4-11H2,1-3H3
InChIKeyFXDBYKHZISJCRC-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.70
Rot. Bonds5

About 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone

1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone (PubChem CID 106614579) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone.

Molecular Properties

Compound Name1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone
PubChem CID106614579
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone
SMILESCC1CN(C(=O)CN(CC2CCCN2)C(C)C)CCO1
InChIInChI=1S/C15H29N3O2/c1-12(2)18(10-14-5-4-6-16-14)11-15(19)17-7-8-20-13(3)9-17/h12-14,16H,4-11H2,1-3H3
InChIKeyFXDBYKHZISJCRC-UHFFFAOYSA-N
XLogP0.70
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methylmorpholin-4-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]ethanone
CID 79705094
1-(2-methylmorpholin-4-yl)-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119698735
4-[[2-(2-methylmorpholin-4-yl)-2-oxoethyl]-propan-2-ylamino]butanoic acid
CID 60834906
1-(2-methyl-1,4-oxazepan-4-yl)-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119771971
2-[propan-2-yl-[[(2R)-pyrrolidin-2-yl]methyl]amino]acetamide
CID 102819407
2-[cyclopropyl(piperidin-3-ylmethyl)amino]-1-(2-methylmorpholin-4-yl)ethanone
CID 106639754
1-(2-methyl-1,4-oxazepan-4-yl)-2-piperidin-2-ylethanone
CID 62972970
1-(2-methylmorpholin-4-yl)-2-[methyl(piperidin-3-ylmethyl)amino]ethanone
CID 106636635
N-(piperidin-2-ylmethyl)-N-propan-2-ylmorpholine-4-carboxamide
CID 106629741
2-[cyclopropyl(3-methylbutyl)amino]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
CID 94061744
2-[cyclopropyl(3-methylbutyl)amino]-1-(2-methylmorpholin-4-yl)ethanone
CID 47025083
1-(2-methylmorpholin-4-yl)-3-piperidin-3-ylbutan-1-one;hydrochloride
CID 119698721

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone?
The IUPAC name of 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone (CID 106614579) is 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone.
What is the SMILES notation for 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone?
The canonical SMILES for 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone is CC1CN(C(=O)CN(CC2CCCN2)C(C)C)CCO1.
What is the InChIKey of 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone?
The InChIKey is FXDBYKHZISJCRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-12(2)18(10-14-5-4-6-16-14)11-15(19)17-7-8-20-13(3)9-17/h12-14,16H,4-11H2,1-3H3.
What are the key properties of 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone?
1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone has a molecular weight of 283.42 g/mol, XLogP of 0.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylmorpholin-4-yl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]ethanone is sourced from PubChem (CID 106614579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).