N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine

C17H30N2 — CID 62261442

IUPACN,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
SMILESCCNCC(C)(CN(CC)C(C)C)c1ccccc1
InChIInChI=1S/C17H30N2/c1-6-18-13-17(5,14-19(7-2)15(3)4)16-11-9-8-10-12-16/h8-12,15,18H,6-7,13-14H2,1-5H3
InChIKeyGRHSCJKJXNONEI-UHFFFAOYSA-N
MW262.44 g/mol
LogP3.28
Rot. Bonds8

About N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine

N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine (PubChem CID 62261442) has the molecular formula C17H30N2 and a molecular weight of 262.44 g/mol. Its IUPAC name is N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
PubChem CID62261442
Molecular FormulaC17H30N2
Molecular Weight262.44 g/mol
Exact Mass262.24
IUPAC NameN,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
SMILESCCNCC(C)(CN(CC)C(C)C)c1ccccc1
InChIInChI=1S/C17H30N2/c1-6-18-13-17(5,14-19(7-2)15(3)4)16-11-9-8-10-12-16/h8-12,15,18H,6-7,13-14H2,1-5H3
InChIKeyGRHSCJKJXNONEI-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-diethyl-2-methyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 62262898
1-[ethyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]-2-methylpropan-2-ol
CID 79377198
N-cyclopropyl-N,N'-diethyl-2-methyl-2-phenylpropane-1,3-diamine
CID 62261792
1-[ethyl(propan-2-yl)amino]-2-phenylpropan-2-ol
CID 62374985
N-ethyl-N',2-dimethyl-2-phenyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256339
N-(cyclopentylmethyl)-N'-ethyl-N,2-dimethyl-2-phenylpropane-1,3-diamine
CID 63631647
N-butan-2-yl-N,2-dimethyl-2-phenyl-N'-propylpropane-1,3-diamine
CID 62263083
2-[ethyl-[2-methyl-3-(2-methylpropylamino)-2-phenylpropyl]amino]ethanol
CID 62258274
2-[cyclobutyl-[3-(ethylamino)-2-methyl-2-phenylpropyl]amino]ethanol
CID 102871059
N,2-dimethyl-2-phenyl-N,N'-di(propan-2-yl)propane-1,3-diamine
CID 62262825
2-methyl-2-phenyl-N,N,N'-tripropylpropane-1,3-diamine
CID 63482320
N-(2,2-dimethylpropyl)-N,2-dimethyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62260878

Frequently Asked Questions

What is the IUPAC name of N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine (CID 62261442) is N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine is CCNCC(C)(CN(CC)C(C)C)c1ccccc1.
What is the InChIKey of N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine?
The InChIKey is GRHSCJKJXNONEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2/c1-6-18-13-17(5,14-19(7-2)15(3)4)16-11-9-8-10-12-16/h8-12,15,18H,6-7,13-14H2,1-5H3.
What are the key properties of N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine?
N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine has a molecular weight of 262.44 g/mol, XLogP of 3.28, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-diethyl-2-methyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 62261442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).