4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen

C24H34N2 — CID 143489836

IUPAC4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen
SMILESC=C(CC(C)(C)C)NCc1c2ccccc2c(CNC)c2ccccc12.[H][H].[H][H]
InChIInChI=1S/C24H30N2.2H2/c1-17(14-24(2,3)4)26-16-23-20-12-8-6-10-18(20)22(15-25-5)19-11-7-9-13-21(19)23;;/h6-13,25-26H,1,14-16H2,2-5H3;2*1H
InChIKeyVUUQIJUHEXUGMN-UHFFFAOYSA-N
MW350.55 g/mol
LogP6.24
Rot. Bonds6

About 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen

4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen (PubChem CID 143489836) has the molecular formula C24H34N2 and a molecular weight of 350.55 g/mol. Its IUPAC name is 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen.

Molecular Properties

Compound Name4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen
PubChem CID143489836
Molecular FormulaC24H34N2
Molecular Weight350.55 g/mol
Exact Mass350.27
IUPAC Name4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen
SMILESC=C(CC(C)(C)C)NCc1c2ccccc2c(CNC)c2ccccc12.[H][H].[H][H]
InChIInChI=1S/C24H30N2.2H2/c1-17(14-24(2,3)4)26-16-23-20-12-8-6-10-18(20)22(15-25-5)19-11-7-9-13-21(19)23;;/h6-13,25-26H,1,14-16H2,2-5H3;2*1H
InChIKeyVUUQIJUHEXUGMN-UHFFFAOYSA-N
XLogP6.24
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.55
LogP ≤ 56.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen?
The IUPAC name of 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen (CID 143489836) is 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen.
What is the SMILES notation for 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen?
The canonical SMILES for 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen is C=C(CC(C)(C)C)NCc1c2ccccc2c(CNC)c2ccccc12.[H][H].[H][H].
What is the InChIKey of 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen?
The InChIKey is VUUQIJUHEXUGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2.2H2/c1-17(14-24(2,3)4)26-16-23-20-12-8-6-10-18(20)22(15-25-5)19-11-7-9-13-21(19)23;;/h6-13,25-26H,1,14-16H2,2-5H3;2*1H.
What are the key properties of 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen?
4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen has a molecular weight of 350.55 g/mol, XLogP of 6.24, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-N-[[10-(methylaminomethyl)anthracen-9-yl]methyl]pent-1-en-2-amine;molecular hydrogen is sourced from PubChem (CID 143489836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).