1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone

C13H25N3O2 — CID 66428532

IUPAC1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone
SMILESCN(C)CC1CCCN1C(=O)CC1CNCCO1
InChIInChI=1S/C13H25N3O2/c1-15(2)10-11-4-3-6-16(11)13(17)8-12-9-14-5-7-18-12/h11-12,14H,3-10H2,1-2H3
InChIKeyHQQVVIXIJQRQFM-UHFFFAOYSA-N
MW255.36 g/mol
LogP-0.08
Rot. Bonds4

About 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone

1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone (PubChem CID 66428532) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone.

Molecular Properties

Compound Name1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone
PubChem CID66428532
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone
SMILESCN(C)CC1CCCN1C(=O)CC1CNCCO1
InChIInChI=1S/C13H25N3O2/c1-15(2)10-11-4-3-6-16(11)13(17)8-12-9-14-5-7-18-12/h11-12,14H,3-10H2,1-2H3
InChIKeyHQQVVIXIJQRQFM-UHFFFAOYSA-N
XLogP-0.08
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-morpholin-2-ylmethanone
CID 62889814
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-morpholin-2-ylethanone
CID 66428289
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-morpholin-2-ylethanone
CID 102726183
3-methyl-1-(2-morpholin-2-ylacetyl)piperidine-2-carboxylic acid
CID 107068760
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-2-morpholin-2-ylacetamide
CID 79314743
N,N-dimethyl-1-[1-(2-morpholin-2-ylethyl)pyrrolidin-2-yl]methanamine
CID 66428357
1-[2-[(2-chlorophenyl)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone
CID 122148242
1-(2-morpholin-2-ylacetyl)piperidine-2-carboxamide;hydrochloride
CID 119685230
N-cyclopropyl-1-(2-morpholin-2-ylacetyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119728140
ethyl 1-(2-morpholin-2-ylacetyl)piperidine-2-carboxylate
CID 66427655
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]propan-1-one
CID 63090742
1-(azepan-1-yl)-2-morpholin-2-ylethanone
CID 66433560

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone?
The IUPAC name of 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone (CID 66428532) is 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone.
What is the SMILES notation for 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone?
The canonical SMILES for 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone is CN(C)CC1CCCN1C(=O)CC1CNCCO1.
What is the InChIKey of 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone?
The InChIKey is HQQVVIXIJQRQFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-15(2)10-11-4-3-6-16(11)13(17)8-12-9-14-5-7-18-12/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone?
1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone has a molecular weight of 255.36 g/mol, XLogP of -0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-morpholin-2-ylethanone is sourced from PubChem (CID 66428532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).