N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine

C18H24N2 — CID 54806369

IUPACN'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine
SMILESCCN(CCNC(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24N2/c1-3-20(18-12-8-5-9-13-18)15-14-19-16(2)17-10-6-4-7-11-17/h4-13,16,19H,3,14-15H2,1-2H3
InChIKeyBJNICSSMDOCJML-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.86
Rot. Bonds7

About N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine

N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine (PubChem CID 54806369) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine
PubChem CID54806369
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine
SMILESCCN(CCNC(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H24N2/c1-3-20(18-12-8-5-9-13-18)15-14-19-16(2)17-10-6-4-7-11-17/h4-13,16,19H,3,14-15H2,1-2H3
InChIKeyBJNICSSMDOCJML-UHFFFAOYSA-N
XLogP3.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(N-ethylanilino)ethylamino]propanenitrile
CID 70583680
N-(1-phenylethyl)-N',N'-dipropylethane-1,2-diamine
CID 54806910
N-(1-phenylethyl)propan-1-amine;hydrochloride
CID 16641251
N,N'-bis[(1R)-1-phenylethyl]propane-1,3-diamine
CID 12964090
N-ethyl-N-phenyl-3-(1-phenylethylamino)propanamide
CID 109020294
N,N'-bis[(1R)-1-phenylethyl]heptane-1,7-diamine
CID 101387383
N'-cyclopropyl-N'-methyl-N-(1-phenylethyl)ethane-1,2-diamine
CID 62975342
N-butyl-N-ethyl-4-[1-(ethylamino)ethyl]aniline
CID 43284157
N,N-dipropyl-3-[1-(propylamino)ethyl]aniline
CID 79678790
N,N-diethylaniline
CID 7061
3,3-diphenyl-N-(1-phenylethyl)propan-1-amine
CID 69294873
N-[(1R)-1-phenylethyl]heptan-1-amine
CID 14866487

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine (CID 54806369) is N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine is CCN(CCNC(C)c1ccccc1)c1ccccc1.
What is the InChIKey of N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine?
The InChIKey is BJNICSSMDOCJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-3-20(18-12-8-5-9-13-18)15-14-19-16(2)17-10-6-4-7-11-17/h4-13,16,19H,3,14-15H2,1-2H3.
What are the key properties of N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine?
N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine has a molecular weight of 268.40 g/mol, XLogP of 3.86, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-phenyl-N-(1-phenylethyl)ethane-1,2-diamine is sourced from PubChem (CID 54806369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).