N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine

C15H24N2 — CID 113409027

IUPACN-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine
SMILESCCNCCN(C)CC1CC1c1ccccc1
InChIInChI=1S/C15H24N2/c1-3-16-9-10-17(2)12-14-11-15(14)13-7-5-4-6-8-13/h4-8,14-16H,3,9-12H2,1-2H3
InChIKeyDRZGRKHVWUOXMV-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.33
Rot. Bonds7

About N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine

N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine (PubChem CID 113409027) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine
PubChem CID113409027
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine
SMILESCCNCCN(C)CC1CC1c1ccccc1
InChIInChI=1S/C15H24N2/c1-3-16-9-10-17(2)12-14-11-15(14)13-7-5-4-6-8-13/h4-8,14-16H,3,9-12H2,1-2H3
InChIKeyDRZGRKHVWUOXMV-UHFFFAOYSA-N
XLogP2.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[(1R,2R)-2-phenylcyclopropyl]methyl]pentan-1-amine
CID 124705421
(2S)-1,1,1-trifluoro-3-[methyl-[[(1R,2S)-2-phenylcyclopropyl]methyl]amino]propan-2-ol
CID 102468969
N'-methyl-N'-[(2-methylcyclopropyl)methyl]-N-phenylethane-1,2-diamine
CID 63865981
[(1R,2R)-2-hexylcyclopropyl]benzene
CID 100977396
N-ethyl-N'-methyl-N'-[(2-methylcyclopropyl)methyl]propane-1,3-diamine
CID 63865857
4,6-dichloro-N-methyl-N-[[(1R,2S)-2-phenylcyclopropyl]methyl]-1,3,5-triazin-2-amine
CID 11023272
N-benzyl-N'-(cyclohexylmethyl)-N'-methylethane-1,2-diamine
CID 62558621
N'-ethyl-N'-methyl-N-(3-phenylcyclobutyl)ethane-1,2-diamine
CID 55097698
2-chloro-N-hydroxy-N-[(2-phenylcyclopropyl)methyl]acetamide
CID 22405882
N-(2,3-dihydro-1H-inden-2-ylmethyl)-N'-ethyl-N'-methylethane-1,2-diamine
CID 114135098
1-hydroxy-1-[[(1R,2R)-2-phenylcyclopropyl]methyl]urea
CID 15015094
2-phenyl-N,N-dipropylcyclopropan-1-amine;hydrochloride
CID 45264199

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine?
The IUPAC name of N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine (CID 113409027) is N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine.
What is the SMILES notation for N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine?
The canonical SMILES for N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine is CCNCCN(C)CC1CC1c1ccccc1.
What is the InChIKey of N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine?
The InChIKey is DRZGRKHVWUOXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-16-9-10-17(2)12-14-11-15(14)13-7-5-4-6-8-13/h4-8,14-16H,3,9-12H2,1-2H3.
What are the key properties of N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine?
N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.33, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N'-methyl-N'-[(2-phenylcyclopropyl)methyl]ethane-1,2-diamine is sourced from PubChem (CID 113409027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).