N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine

C14H24N2 — CID 144547155

IUPACN-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine
SMILESCCC(CCNC)c1cccc(CNC)c1
InChIInChI=1S/C14H24N2/c1-4-13(8-9-15-2)14-7-5-6-12(10-14)11-16-3/h5-7,10,13,15-16H,4,8-9,11H2,1-3H3
InChIKeyCMJWMNMXCRZSBH-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.51
Rot. Bonds7

About N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine

N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine (PubChem CID 144547155) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine
PubChem CID144547155
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine
SMILESCCC(CCNC)c1cccc(CNC)c1
InChIInChI=1S/C14H24N2/c1-4-13(8-9-15-2)14-7-5-6-12(10-14)11-16-3/h5-7,10,13,15-16H,4,8-9,11H2,1-3H3
InChIKeyCMJWMNMXCRZSBH-UHFFFAOYSA-N
XLogP2.51
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N-methyl-3-phenylpentan-1-amine
CID 165125181
ethane;3-(4-hydroxyphenyl)-N-[3-[3-(methylaminomethyl)phenyl]pentyl]propanamide
CID 144547562
3-[3-(aminomethyl)phenyl]-N-methylpentan-1-amine;(E)-3-[4-hydroxy-3-(hydroxymethyl)phenyl]prop-2-enal
CID 144853235
4-[1-(methylamino)pentan-3-yl]aniline
CID 142395580
1-[4-(1-methoxypentan-3-yl)phenyl]-N-methylmethanamine
CID 142365268
N-methyl-1-[3-(3-methylbutylsulfanyl)phenyl]methanamine
CID 66347042
N-methyl-1-[3-(2-methylbutylsulfanyl)phenyl]methanamine
CID 66349587
3-(3-heptan-3-ylphenyl)propanal
CID 155690788
1-[3-(chloromethyl)phenyl]-4-(methylamino)butane-1,2-diol
CID 171889742
2-(3-ethylphenyl)-N'-methylpropane-1,3-diamine
CID 20546137
1-[3-(2-ethylhexylsulfanyl)phenyl]-N-methylmethanamine
CID 66348605
ethane;4-(4-hydroxyphenyl)butan-2-one;N-methyl-1-(3-nonan-4-ylphenyl)methanamine
CID 144853439

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine?
The IUPAC name of N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine (CID 144547155) is N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine.
What is the SMILES notation for N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine?
The canonical SMILES for N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine is CCC(CCNC)c1cccc(CNC)c1.
What is the InChIKey of N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine?
The InChIKey is CMJWMNMXCRZSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-4-13(8-9-15-2)14-7-5-6-12(10-14)11-16-3/h5-7,10,13,15-16H,4,8-9,11H2,1-3H3.
What are the key properties of N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine?
N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine has a molecular weight of 220.36 g/mol, XLogP of 2.51, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[3-(methylaminomethyl)phenyl]pentan-1-amine is sourced from PubChem (CID 144547155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).