N,N',N'-triethyl-1-phenylethane-1,2-diamine

C14H24N2 — CID 60695169

IUPACN,N',N'-triethyl-1-phenylethane-1,2-diamine
SMILESCCNC(CN(CC)CC)c1ccccc1
InChIInChI=1S/C14H24N2/c1-4-15-14(12-16(5-2)6-3)13-10-8-7-9-11-13/h7-11,14-15H,4-6,12H2,1-3H3
InChIKeyKXXGELBCDSQVRS-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.68
Rot. Bonds7

About N,N',N'-triethyl-1-phenylethane-1,2-diamine

N,N',N'-triethyl-1-phenylethane-1,2-diamine (PubChem CID 60695169) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N,N',N'-triethyl-1-phenylethane-1,2-diamine.

Molecular Properties

Compound NameN,N',N'-triethyl-1-phenylethane-1,2-diamine
PubChem CID60695169
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN,N',N'-triethyl-1-phenylethane-1,2-diamine
SMILESCCNC(CN(CC)CC)c1ccccc1
InChIInChI=1S/C14H24N2/c1-4-15-14(12-16(5-2)6-3)13-10-8-7-9-11-13/h7-11,14-15H,4-6,12H2,1-3H3
InChIKeyKXXGELBCDSQVRS-UHFFFAOYSA-N
XLogP2.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(cyclopropylmethyl)-N'-ethyl-1-phenyl-N-propylethane-1,2-diamine
CID 63955974
N'-[2-(diethylamino)ethyl]-N'-ethyl-N-[(4-fluorophenyl)methyl]-1-phenylethane-1,2-diamine
CID 58256144
1-[(1S)-2-(diethylamino)-1-phenylethyl]-3-phenylurea
CID 8933297
N-benzhydrylethanamine;ethane
CID 142974710
N'-(2-ethoxyethyl)-N,N'-diethyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 63697022
N-ethyl-3,3,3-trifluoro-1-phenylpropan-1-amine
CID 43489138
N-ethyl-2-ethylsulfanyl-1-phenylethanamine
CID 64613608
2-butan-2-ylsulfanyl-N-ethyl-1-phenylethanamine
CID 64613420
N-ethyl-1-(4-ethylphenyl)-N'-methyl-N'-phenylethane-1,2-diamine
CID 63466547
(1S)-N-ethyl-1-phenyl-2-pyridin-2-ylethanamine
CID 129365604
N-chloro-N',N'-diethyl-1-phenylpropane-1,3-diamine
CID 23557495
N',N'-dimethyl-1-phenyl-N-propylethane-1,2-diamine
CID 43203951

Frequently Asked Questions

What is the IUPAC name of N,N',N'-triethyl-1-phenylethane-1,2-diamine?
The IUPAC name of N,N',N'-triethyl-1-phenylethane-1,2-diamine (CID 60695169) is N,N',N'-triethyl-1-phenylethane-1,2-diamine.
What is the SMILES notation for N,N',N'-triethyl-1-phenylethane-1,2-diamine?
The canonical SMILES for N,N',N'-triethyl-1-phenylethane-1,2-diamine is CCNC(CN(CC)CC)c1ccccc1.
What is the InChIKey of N,N',N'-triethyl-1-phenylethane-1,2-diamine?
The InChIKey is KXXGELBCDSQVRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-4-15-14(12-16(5-2)6-3)13-10-8-7-9-11-13/h7-11,14-15H,4-6,12H2,1-3H3.
What are the key properties of N,N',N'-triethyl-1-phenylethane-1,2-diamine?
N,N',N'-triethyl-1-phenylethane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',N'-triethyl-1-phenylethane-1,2-diamine is sourced from PubChem (CID 60695169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).