2-(1H-pyrrol-2-ylmethyl)morpholine

C9H14N2O — CID 116927846

IUPAC2-(1H-pyrrol-2-ylmethyl)morpholine
SMILESc1c[nH]c(CC2CNCCO2)c1
InChIInChI=1S/C9H14N2O/c1-2-8(11-3-1)6-9-7-10-4-5-12-9/h1-3,9-11H,4-7H2
InChIKeyGFWALOBIPFCJMP-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.55
Rot. Bonds2

About 2-(1H-pyrrol-2-ylmethyl)morpholine

2-(1H-pyrrol-2-ylmethyl)morpholine (PubChem CID 116927846) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 2-(1H-pyrrol-2-ylmethyl)morpholine.

Molecular Properties

Compound Name2-(1H-pyrrol-2-ylmethyl)morpholine
PubChem CID116927846
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name2-(1H-pyrrol-2-ylmethyl)morpholine
SMILESc1c[nH]c(CC2CNCCO2)c1
InChIInChI=1S/C9H14N2O/c1-2-8(11-3-1)6-9-7-10-4-5-12-9/h1-3,9-11H,4-7H2
InChIKeyGFWALOBIPFCJMP-UHFFFAOYSA-N
XLogP0.55
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[4-methyl-6-(1H-pyrrol-2-yl)pyrimidin-2-yl]methyl]morpholine
CID 116895639
[4-(morpholin-2-ylmethyl)phenyl]methanamine
CID 174949580
2-[(4-bromophenyl)methyl]morpholine
CID 66730468
(2R)-2-[(2-methoxyphenyl)methyl]morpholine
CID 58689699
2-(morpholin-2-ylmethyl)morpholine
CID 18506039
(1R)-2-[(2S)-morpholin-2-yl]-1-phenylethanol
CID 91338656
2-morpholin-2-ylethanol;toluene
CID 118211589
2-(quinolin-4-ylmethyl)morpholine
CID 116985426
2-[(4-piperidin-3-ylphenyl)methyl]morpholine
CID 116988313
N-(morpholin-2-ylmethyl)thiophen-2-amine
CID 115237433
2-[2-(4-methylphenoxy)ethyl]morpholine
CID 54402236
2-morpholin-2-ylethanol;hydrofluoride
CID 69116594

Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrrol-2-ylmethyl)morpholine?
The IUPAC name of 2-(1H-pyrrol-2-ylmethyl)morpholine (CID 116927846) is 2-(1H-pyrrol-2-ylmethyl)morpholine.
What is the SMILES notation for 2-(1H-pyrrol-2-ylmethyl)morpholine?
The canonical SMILES for 2-(1H-pyrrol-2-ylmethyl)morpholine is c1c[nH]c(CC2CNCCO2)c1.
What is the InChIKey of 2-(1H-pyrrol-2-ylmethyl)morpholine?
The InChIKey is GFWALOBIPFCJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-2-8(11-3-1)6-9-7-10-4-5-12-9/h1-3,9-11H,4-7H2.
What are the key properties of 2-(1H-pyrrol-2-ylmethyl)morpholine?
2-(1H-pyrrol-2-ylmethyl)morpholine has a molecular weight of 166.22 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrrol-2-ylmethyl)morpholine is sourced from PubChem (CID 116927846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).