N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine

C13H20N2 — CID 62418713

IUPACN-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine
SMILESCNCc1ccc(CN(C)C2CC2)cc1
InChIInChI=1S/C13H20N2/c1-14-9-11-3-5-12(6-4-11)10-15(2)13-7-8-13/h3-6,13-14H,7-10H2,1-2H3
InChIKeySGMCEHYYIJWVKA-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.00
Rot. Bonds5

About N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine

N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine (PubChem CID 62418713) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine
PubChem CID62418713
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine
SMILESCNCc1ccc(CN(C)C2CC2)cc1
InChIInChI=1S/C13H20N2/c1-14-9-11-3-5-12(6-4-11)10-15(2)13-7-8-13/h3-6,13-14H,7-10H2,1-2H3
InChIKeySGMCEHYYIJWVKA-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclohexanamine
CID 62424446
N-methyl-N-[[4-(propylaminomethyl)phenyl]methyl]cyclopropanamine
CID 55129561
4-[[methyl-[4-(methylamino)cyclohexyl]amino]methyl]benzonitrile
CID 79122853
N-(2-methoxyethyl)-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine
CID 62435763
N-[[4-(ethylaminomethyl)phenyl]methyl]-N-methyloxan-4-amine
CID 62431673
4-[benzyl(methyl)amino]-1-(methylaminomethyl)cyclohexan-1-ol
CID 117038147
CID 174466109
CID 174466109
4-[[methyl-(4-methylcyclohexyl)amino]methyl]aniline
CID 55135728
N-[[2-methoxy-5-(methylaminomethyl)phenyl]methyl]-N-methylcycloheptanamine
CID 62018728
N-[[2-methoxy-5-(methylaminomethyl)phenyl]methyl]-N-methylcyclohexanamine
CID 62017781
N-cyclopentyl-N-methyl-4-(methylaminomethyl)benzenesulfonamide
CID 60823251
N-[(4-fluorophenyl)methyl]-N-[4-[4-(methylaminomethyl)phenyl]cyclohexyl]acetamide
CID 19381473

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine (CID 62418713) is N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine is CNCc1ccc(CN(C)C2CC2)cc1.
What is the InChIKey of N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine?
The InChIKey is SGMCEHYYIJWVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-14-9-11-3-5-12(6-4-11)10-15(2)13-7-8-13/h3-6,13-14H,7-10H2,1-2H3.
What are the key properties of N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine?
N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine has a molecular weight of 204.32 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 62418713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).