N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine

C13H20N2 — CID 43263914

IUPACN-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine
SMILESCCN(Cc1ccccc1CN)C1CC1
InChIInChI=1S/C13H20N2/c1-2-15(13-7-8-13)10-12-6-4-3-5-11(12)9-14/h3-6,13H,2,7-10,14H2,1H3
InChIKeyRRLIWPZAUFBRTO-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.13
Rot. Bonds5

About N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine

N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine (PubChem CID 43263914) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine.

Molecular Properties

Compound NameN-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine
PubChem CID43263914
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine
SMILESCCN(Cc1ccccc1CN)C1CC1
InChIInChI=1S/C13H20N2/c1-2-15(13-7-8-13)10-12-6-4-3-5-11(12)9-14/h3-6,13H,2,7-10,14H2,1H3
InChIKeyRRLIWPZAUFBRTO-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 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 ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[cyclopropyl(ethyl)amino]methyl]-2-fluoroaniline
CID 107347213
N-ethyl-N-[[2-[2-(ethylamino)ethyl]phenyl]methyl]cyclopropanamine
CID 113314751
4-N-[(2-bromophenyl)methyl]-4-N-ethylcyclohexane-1,4-diamine
CID 79115581
2-[[cyclopropyl(ethyl)amino]methyl]benzohydrazide
CID 63572317
N-[[3-(aminomethyl)furan-2-yl]methyl]-N-ethylcyclopropanamine
CID 62420146
N-[[2-(aminomethyl)phenyl]methyl]-N-(thiophen-3-ylmethyl)cyclopropanamine
CID 61433648
[2-[(dimethylamino)methyl]phenyl]methanamine
CID 4962718
1-[2-(aminomethyl)phenoxy]-3-[cyclopropyl(ethyl)amino]propan-2-ol
CID 43263892
N-ethyl-N-[(2-ethylphenyl)methyl]azetidin-3-amine
CID 66181431
N-[[3-(aminomethyl)-2-fluorophenyl]methyl]-N-benzylcyclopropanamine
CID 107113137
2-[[cyclohexyl(ethyl)amino]methyl]benzohydrazide
CID 63571134
N-[[2-(aminomethyl)phenyl]methyl]-N-methyloxolan-3-amine
CID 63558537

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine?
The IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine (CID 43263914) is N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine.
What is the SMILES notation for N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine?
The canonical SMILES for N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine is CCN(Cc1ccccc1CN)C1CC1.
What is the InChIKey of N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine?
The InChIKey is RRLIWPZAUFBRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-2-15(13-7-8-13)10-12-6-4-3-5-11(12)9-14/h3-6,13H,2,7-10,14H2,1H3.
What are the key properties of N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine?
N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine has a molecular weight of 204.32 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)phenyl]methyl]-N-ethylcyclopropanamine is sourced from PubChem (CID 43263914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).