N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine

C15H32N2 — CID 91426963

IUPACN,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine
SMILESCC.CC.CN(C)Cc1ccccc1.CNC
InChIInChI=1S/C9H13N.C2H7N.2C2H6/c1-10(2)8-9-6-4-3-5-7-9;1-3-2;2*1-2/h3-7H,8H2,1-2H3;3H,1-2H3;2*1-2H3
InChIKeyIFEMZCZTFRICDG-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.64
Rot. Bonds2

About N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine

N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine (PubChem CID 91426963) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine
PubChem CID91426963
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine
SMILESCC.CC.CN(C)Cc1ccccc1.CNC
InChIInChI=1S/C9H13N.C2H7N.2C2H6/c1-10(2)8-9-6-4-3-5-7-9;1-3-2;2*1-2/h3-7H,8H2,1-2H3;3H,1-2H3;2*1-2H3
InChIKeyIFEMZCZTFRICDG-UHFFFAOYSA-N
XLogP3.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

benzene;N,N-dimethyl-1-phenylmethanamine;ethane
CID 90785154
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N,N-dimethyl-1-phenylmethanamine;tetrahydrochloride
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CID 71592559
carbonic acid;N,N-dimethyl-1-phenylmethanamine
CID 69138278
N,N-dimethyl-1-phenylmethanamine;1H-pyrrole
CID 162180373
N,N-dimethyl-1-phenylmethanamine;N-ethyl-N-methylethanamine
CID 154948707
2-[bis(2-hydroxyethyl)amino]ethanol;N,N-dimethyl-1-phenylmethanamine
CID 67016805
N-chloro-1-phenylmethanamine;N,N-dimethyl-1-phenylmethanamine;dihydrochloride
CID 175067673
butane;N,N-dibutylbutan-1-amine;bis(N,N-dimethyl-1-phenylmethanamine)
CID 90732406
N-benzyl-1-deuterio-N-methylmethanamine;hydrochloride
CID 155774731

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine?
The IUPAC name of N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine (CID 91426963) is N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine.
What is the SMILES notation for N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine?
The canonical SMILES for N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine is CC.CC.CN(C)Cc1ccccc1.CNC.
What is the InChIKey of N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine?
The InChIKey is IFEMZCZTFRICDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N.C2H7N.2C2H6/c1-10(2)8-9-6-4-3-5-7-9;1-3-2;2*1-2/h3-7H,8H2,1-2H3;3H,1-2H3;2*1-2H3.
What are the key properties of N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine?
N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine has a molecular weight of 240.43 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine is sourced from PubChem (CID 91426963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).