2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine

C15H27N3O — CID 66406201

IUPAC2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCc1ccn(CCN2CCOCC2)c1
InChIInChI=1S/C15H27N3O/c1-15(2,3)16-12-14-4-5-18(13-14)7-6-17-8-10-19-11-9-17/h4-5,13,16H,6-12H2,1-3H3
InChIKeyOAKILAXDYHFUAW-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.71
Rot. Bonds5

About 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine

2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine (PubChem CID 66406201) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine
PubChem CID66406201
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCc1ccn(CCN2CCOCC2)c1
InChIInChI=1S/C15H27N3O/c1-15(2,3)16-12-14-4-5-18(13-14)7-6-17-8-10-19-11-9-17/h4-5,13,16H,6-12H2,1-3H3
InChIKeyOAKILAXDYHFUAW-UHFFFAOYSA-N
XLogP1.71
TPSA29.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-[(tert-butylamino)methyl]pyrrol-1-yl]-1-morpholin-4-ylethanone
CID 66403976
[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methanol
CID 66398918
N-[[1-(3,3-dimethylbutyl)pyrrol-3-yl]methyl]-2-methylpropan-2-amine
CID 66404786
N-[[1-(2-tert-butylsulfonylethyl)pyrrol-3-yl]methyl]-2-methylpropan-2-amine
CID 106717726
1-(2-morpholin-4-ylethyl)pyrrole-3-carbaldehyde
CID 66408586
2-methyl-N-[[1-[2-(1-methylimidazol-2-yl)ethyl]pyrrol-3-yl]methyl]propan-2-amine
CID 114528934
N-[[1-[(4-chlorophenyl)methyl]pyrrol-3-yl]methyl]-2-methylpropan-2-amine
CID 66404585
N-[[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]methyl]-2-methylpropan-2-amine
CID 103411288
N-[1-[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]ethyl]propan-1-amine
CID 79099347
2-methyl-N-[[1-(pyridin-4-ylmethyl)pyrrol-3-yl]methyl]propan-2-amine
CID 66404386
[1-[2-(4-methylpiperazin-1-yl)ethyl]pyrrol-3-yl]methanamine
CID 82891821
[1-[2-(4-methylpiperazin-1-yl)ethyl]pyrrol-3-yl]methanol
CID 82891582

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine (CID 66406201) is 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine is CC(C)(C)NCc1ccn(CCN2CCOCC2)c1.
What is the InChIKey of 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine?
The InChIKey is OAKILAXDYHFUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-15(2,3)16-12-14-4-5-18(13-14)7-6-17-8-10-19-11-9-17/h4-5,13,16H,6-12H2,1-3H3.
What are the key properties of 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine?
2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine has a molecular weight of 265.40 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 66406201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).