N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline

C18H30N2 — CID 160863043

IUPACN,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline
SMILESCNc1c(C)c(N2CCCCC2)c(C)c(C)c1C(C)C
InChIInChI=1S/C18H30N2/c1-12(2)16-13(3)14(4)18(15(5)17(16)19-6)20-10-8-7-9-11-20/h12,19H,7-11H2,1-6H3
InChIKeyCCKBSHRJAKFHHD-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.77
Rot. Bonds3

About N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline

N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline (PubChem CID 160863043) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline.

Molecular Properties

Compound NameN,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline
PubChem CID160863043
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline
SMILESCNc1c(C)c(N2CCCCC2)c(C)c(C)c1C(C)C
InChIInChI=1S/C18H30N2/c1-12(2)16-13(3)14(4)18(15(5)17(16)19-6)20-10-8-7-9-11-20/h12,19H,7-11H2,1-6H3
InChIKeyCCKBSHRJAKFHHD-UHFFFAOYSA-N
XLogP4.77
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline;N,2,4,5-tetramethyl-6-propan-2-yl-3-pyrrolidin-1-ylaniline
CID 160863041
1-[2,6-di(propan-2-yl)phenyl]piperidine
CID 10634131
3,5,6-trimethyl-4-piperidin-1-yl-1H-pyridine-2-thione
CID 143681669
2-methyl-1,3-di(propan-2-yl)-5,6,7,8-tetrahydroindolizine
CID 139302594
2-(azepan-1-yl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 62913450
N-[(4-piperidin-1-ylphenyl)methyl]propan-2-amine
CID 7060595
6-N-methyl-4-N-(2-piperidin-1-ylethyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80804448
1-(azepan-1-yl)-N,3-dimethylisoquinolin-4-amine
CID 82572469
40,41-dimethyl-1,20-diazatricyclo[18.18.4.239,42]tetratetraconta-39,41,43-triene
CID 177473830
N-methyl-1-(4-pyrrolidin-1-ylphenyl)ethanamine
CID 43283919
4-methyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]pentan-1-amine
CID 54913869
N-ethyl-5-methyl-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80981685

Frequently Asked Questions

What is the IUPAC name of N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline?
The IUPAC name of N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline (CID 160863043) is N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline.
What is the SMILES notation for N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline?
The canonical SMILES for N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline is CNc1c(C)c(N2CCCCC2)c(C)c(C)c1C(C)C.
What is the InChIKey of N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline?
The InChIKey is CCKBSHRJAKFHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-12(2)16-13(3)14(4)18(15(5)17(16)19-6)20-10-8-7-9-11-20/h12,19H,7-11H2,1-6H3.
What are the key properties of N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline?
N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline has a molecular weight of 274.45 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4,5-tetramethyl-3-piperidin-1-yl-6-propan-2-ylaniline is sourced from PubChem (CID 160863043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).