1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine

C15H26N2O2 — CID 103411328

IUPAC1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine
SMILESCNC(c1ccn(CCCOCCOC)c1)C1CC1
InChIInChI=1S/C15H26N2O2/c1-16-15(13-4-5-13)14-6-8-17(12-14)7-3-9-19-11-10-18-2/h6,8,12-13,15-16H,3-5,7,9-11H2,1-2H3
InChIKeyKAVJJLBRFBIPNK-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.21
Rot. Bonds10

About 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine

1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine (PubChem CID 103411328) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine
PubChem CID103411328
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine
SMILESCNC(c1ccn(CCCOCCOC)c1)C1CC1
InChIInChI=1S/C15H26N2O2/c1-16-15(13-4-5-13)14-6-8-17(12-14)7-3-9-19-11-10-18-2/h6,8,12-13,15-16H,3-5,7,9-11H2,1-2H3
InChIKeyKAVJJLBRFBIPNK-UHFFFAOYSA-N
XLogP2.21
TPSA35.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-cyclopropyl-N-methyl-1-[1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrrol-3-yl]methanamine
CID 79103755
1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N,2-dimethylpropan-1-amine
CID 103411322
1-cyclopropyl-1-[1-(4,4-dimethylpentyl)pyrrol-3-yl]-N-methylmethanamine
CID 114209707
cyclopropyl-[1-[2-(2-methoxyethoxy)ethyl]pyrrol-3-yl]methanamine
CID 79104518
methyl 2-[3-[cyclopropyl(methylamino)methyl]pyrrol-1-yl]acetate
CID 79103308
1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]butan-1-amine
CID 103411315
1-[1-[2-(2-methoxyethoxy)ethyl]pyrrol-3-yl]-N-methylbutan-1-amine
CID 79109268
1-cyclopropyl-N-methyl-1-[1-[2-(1-methylpiperidin-2-yl)ethyl]pyrrol-3-yl]methanamine
CID 107913107
1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-2-methyl-N-propylpropan-1-amine
CID 103411325
1-[1-[(4-bromophenyl)methyl]pyrrol-3-yl]-1-cyclopropyl-N-methylmethanamine
CID 79104017
cyclopropyl-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]methanone
CID 103411195
methyl 4-[3-[cyclopropyl(ethylamino)methyl]pyrrol-1-yl]butanoate
CID 79103936

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine?
The IUPAC name of 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine (CID 103411328) is 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine is CNC(c1ccn(CCCOCCOC)c1)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine?
The InChIKey is KAVJJLBRFBIPNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-16-15(13-4-5-13)14-6-8-17(12-14)7-3-9-19-11-10-18-2/h6,8,12-13,15-16H,3-5,7,9-11H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine?
1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine has a molecular weight of 266.38 g/mol, XLogP of 2.21, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-[1-[3-(2-methoxyethoxy)propyl]pyrrol-3-yl]-N-methylmethanamine is sourced from PubChem (CID 103411328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).