[1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine

C17H25N3O — CID 64532953

IUPAC[1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine
SMILESCC(C)N1CCOC(Cn2ccc3c(CN)cccc32)C1
InChIInChI=1S/C17H25N3O/c1-13(2)19-8-9-21-15(11-19)12-20-7-6-16-14(10-18)4-3-5-17(16)20/h3-7,13,15H,8-12,18H2,1-2H3
InChIKeyJCPNFRIGOIOVQB-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.21
Rot. Bonds4

About [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine

[1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine (PubChem CID 64532953) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine.

Molecular Properties

Compound Name[1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine
PubChem CID64532953
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name[1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine
SMILESCC(C)N1CCOC(Cn2ccc3c(CN)cccc32)C1
InChIInChI=1S/C17H25N3O/c1-13(2)19-8-9-21-15(11-19)12-20-7-6-16-14(10-18)4-3-5-17(16)20/h3-7,13,15H,8-12,18H2,1-2H3
InChIKeyJCPNFRIGOIOVQB-UHFFFAOYSA-N
XLogP2.21
TPSA43.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine with MolForge

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Related Compounds

2-[(4,6-dichloroindol-1-yl)methyl]-4-propan-2-ylmorpholine
CID 103428431
2-[(5-methylindol-1-yl)methyl]-4-propan-2-ylmorpholine
CID 116622956
1-[(4-methylmorpholin-2-yl)methyl]indol-4-amine
CID 79172400
3-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrole-2-carboxylic acid
CID 102604816
1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrole-2-carbaldehyde
CID 66407258
1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrimidine-2,4-dione
CID 64533566
N-[1-[1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrol-2-yl]ethyl]propan-1-amine
CID 79108697
1-[4-(aminomethyl)indol-1-yl]-3-methylbutan-2-ol
CID 114249890
N-[(2-ethylphenyl)methyl]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 64681381
4-propan-2-yl-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylmethyl)morpholine
CID 12832486
2-[4-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-diazepan-1-yl]ethanamine
CID 64533682
2-[(5-methylpyrazol-1-yl)methyl]-4-propan-2-ylmorpholine
CID 64534558

Frequently Asked Questions

What is the IUPAC name of [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine?
The IUPAC name of [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine (CID 64532953) is [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine.
What is the SMILES notation for [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine?
The canonical SMILES for [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine is CC(C)N1CCOC(Cn2ccc3c(CN)cccc32)C1.
What is the InChIKey of [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine?
The InChIKey is JCPNFRIGOIOVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-13(2)19-8-9-21-15(11-19)12-20-7-6-16-14(10-18)4-3-5-17(16)20/h3-7,13,15H,8-12,18H2,1-2H3.
What are the key properties of [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine?
[1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine has a molecular weight of 287.41 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-propan-2-ylmorpholin-2-yl)methyl]indol-4-yl]methanamine is sourced from PubChem (CID 64532953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).