N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine

C15H21N3O — CID 115238025

IUPACN-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine
SMILESCc1[nH]c2ccccc2c1CNCC1COCCN1
InChIInChI=1S/C15H21N3O/c1-11-14(13-4-2-3-5-15(13)18-11)9-16-8-12-10-19-7-6-17-12/h2-5,12,16-18H,6-10H2,1H3
InChIKeyLZIYDSMJAGUBKK-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.55
Rot. Bonds4

About N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine

N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine (PubChem CID 115238025) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine.

Molecular Properties

Compound NameN-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine
PubChem CID115238025
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine
SMILESCc1[nH]c2ccccc2c1CNCC1COCCN1
InChIInChI=1S/C15H21N3O/c1-11-14(13-4-2-3-5-15(13)18-11)9-16-8-12-10-19-7-6-17-12/h2-5,12,16-18H,6-10H2,1H3
InChIKeyLZIYDSMJAGUBKK-UHFFFAOYSA-N
XLogP1.55
TPSA49.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

1-(2-methyl-1H-indol-3-yl)-2-morpholin-3-ylethanamine
CID 116941500
1-morpholin-3-yl-N-[(4-propylphenyl)methyl]methanamine
CID 115238003
N-[(4-tert-butylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115237984
N-[(4-methoxy-3,5-dimethylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115238057
N-methyl-N'-[(2-methyl-1H-indol-3-yl)methyl]ethane-1,2-diamine
CID 115195851
2-methyl-N-(morpholin-3-ylmethyl)quinolin-4-amine
CID 103549152
N-[(2-methoxy-3,5-dimethylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115238028
2,2-dimethyl-N'-[(2-methyl-1H-indol-3-yl)methyl]propane-1,3-diamine
CID 115200029
2-(2-bromophenyl)-2-methyl-N-(morpholin-3-ylmethyl)propan-1-amine
CID 115238227
2-methyl-N-(morpholin-3-ylmethyl)-2-pyridin-2-ylpropan-1-amine
CID 115238220
N-[(2-methyl-1H-indol-3-yl)methyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine
CID 17463435
N-(chloromethyl)-2-(2-methyl-1H-indol-3-yl)ethanamine
CID 115263355

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine?
The IUPAC name of N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine (CID 115238025) is N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine.
What is the SMILES notation for N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine?
The canonical SMILES for N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine is Cc1[nH]c2ccccc2c1CNCC1COCCN1.
What is the InChIKey of N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine?
The InChIKey is LZIYDSMJAGUBKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11-14(13-4-2-3-5-15(13)18-11)9-16-8-12-10-19-7-6-17-12/h2-5,12,16-18H,6-10H2,1H3.
What are the key properties of N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine?
N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine has a molecular weight of 259.35 g/mol, XLogP of 1.55, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1H-indol-3-yl)methyl]-1-morpholin-3-ylmethanamine is sourced from PubChem (CID 115238025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).