N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine

C15H27N3O — CID 79182288

IUPACN-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine
SMILESCCNC(C)c1cccn1CC1CN(CC)CCO1
InChIInChI=1S/C15H27N3O/c1-4-16-13(3)15-7-6-8-18(15)12-14-11-17(5-2)9-10-19-14/h6-8,13-14,16H,4-5,9-12H2,1-3H3
InChIKeyLREJCLBHGWUMGE-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.88
Rot. Bonds6

About N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine

N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine (PubChem CID 79182288) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine
PubChem CID79182288
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC NameN-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine
SMILESCCNC(C)c1cccn1CC1CN(CC)CCO1
InChIInChI=1S/C15H27N3O/c1-4-16-13(3)15-7-6-8-18(15)12-14-11-17(5-2)9-10-19-14/h6-8,13-14,16H,4-5,9-12H2,1-3H3
InChIKeyLREJCLBHGWUMGE-UHFFFAOYSA-N
XLogP1.88
TPSA29.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrol-2-yl]ethyl]propan-1-amine
CID 79108697
N-ethyl-1-[1-[(5-methyloxolan-2-yl)methyl]pyrrol-2-yl]ethanamine
CID 103136333
(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-phenylethanamine
CID 79165339
1-[(4-ethylmorpholin-2-yl)methyl]pyrimidin-2-one
CID 116618394
N-[(4-ethylmorpholin-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 79164854
(1S)-N-[(4-ethylmorpholin-2-yl)methyl]-1-(4-fluorophenyl)ethanamine
CID 81347515
2,4-diethylmorpholine
CID 58988021
4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol
CID 114399621
3-[(4-ethylmorpholin-2-yl)methyl]-4-propan-2-yl-1H-imidazole-2-thione
CID 114400973
1-[(4-ethylmorpholin-2-yl)methyl]indole-3-carboxylic acid
CID 79175356
N-[(4-ethylmorpholin-2-yl)methyl]-1-(3-fluorophenyl)ethanamine
CID 78946838
1-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroindol-4-amine
CID 114401128

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine (CID 79182288) is N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine is CCNC(C)c1cccn1CC1CN(CC)CCO1.
What is the InChIKey of N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine?
The InChIKey is LREJCLBHGWUMGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-4-16-13(3)15-7-6-8-18(15)12-14-11-17(5-2)9-10-19-14/h6-8,13-14,16H,4-5,9-12H2,1-3H3.
What are the key properties of N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine?
N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine has a molecular weight of 265.40 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-[(4-ethylmorpholin-2-yl)methyl]pyrrol-2-yl]ethanamine is sourced from PubChem (CID 79182288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).