2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine

C11H19N3O — CID 60663033

IUPAC2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine
SMILESc1c[nH]c(CNCCN2CCOCC2)c1
InChIInChI=1S/C11H19N3O/c1-2-11(13-3-1)10-12-4-5-14-6-8-15-9-7-14/h1-3,12-13H,4-10H2
InChIKeyONEDSUHFZCZULX-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.44
Rot. Bonds5

About 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine

2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine (PubChem CID 60663033) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine
PubChem CID60663033
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine
SMILESc1c[nH]c(CNCCN2CCOCC2)c1
InChIInChI=1S/C11H19N3O/c1-2-11(13-3-1)10-12-4-5-14-6-8-15-9-7-14/h1-3,12-13H,4-10H2
InChIKeyONEDSUHFZCZULX-UHFFFAOYSA-N
XLogP0.44
TPSA40.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

ethane;N-(2-morpholin-4-ylethyl)-3-phenyl-3-(1H-pyrrol-2-yl)propan-1-amine
CID 143466541
N-[(2-methyl-1H-imidazol-5-yl)methyl]-2-morpholin-4-ylethanamine
CID 62742690
4-[(2-morpholin-4-ylethylamino)methyl]-3H-1,3-thiazol-2-one
CID 106381057
3-(1H-pyrrol-2-ylmethyl)-1,3-oxazolidine
CID 139266830
N-[(2-methylphenyl)methyl]-2-morpholin-4-ylethanamine;dihydrochloride
CID 2968793
N-[(4-ethylphenyl)methyl]-2-morpholin-4-ylethanamine;dihydrochloride
CID 2968647
N-(2,3-dihydro-1H-indol-7-ylmethyl)-2-morpholin-4-ylethanamine
CID 80649987
2-morpholin-4-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamine
CID 43220540
N-[[4-(difluoromethyl)phenyl]methyl]-2-morpholin-4-ylethanamine
CID 115523459
2-(2-morpholin-4-ylethylamino)-2-(1H-pyrrol-2-yl)acetic acid
CID 84748088
3-morpholin-4-yl-N-[[4-[(3-morpholin-4-ylpropylamino)methyl]phenyl]methyl]propan-1-amine
CID 24899046
2-morpholin-4-yl-N-(quinoxalin-2-ylmethyl)ethanamine
CID 43764194

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine?
The IUPAC name of 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine (CID 60663033) is 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine?
The canonical SMILES for 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine is c1c[nH]c(CNCCN2CCOCC2)c1.
What is the InChIKey of 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine?
The InChIKey is ONEDSUHFZCZULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-11(13-3-1)10-12-4-5-14-6-8-15-9-7-14/h1-3,12-13H,4-10H2.
What are the key properties of 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine?
2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine has a molecular weight of 209.29 g/mol, XLogP of 0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine is sourced from PubChem (CID 60663033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).