4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline

C16H26N2 — CID 79549376

IUPAC4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline
SMILESCCc1ccc(NC(C)CC2CCCCN2)cc1
InChIInChI=1S/C16H26N2/c1-3-14-7-9-15(10-8-14)18-13(2)12-16-6-4-5-11-17-16/h7-10,13,16-18H,3-6,11-12H2,1-2H3
InChIKeyYBSGDWFUYVLJPZ-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.58
Rot. Bonds5

About 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline

4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline (PubChem CID 79549376) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline.

Molecular Properties

Compound Name4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline
PubChem CID79549376
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline
SMILESCCc1ccc(NC(C)CC2CCCCN2)cc1
InChIInChI=1S/C16H26N2/c1-3-14-7-9-15(10-8-14)18-13(2)12-16-6-4-5-11-17-16/h7-10,13,16-18H,3-6,11-12H2,1-2H3
InChIKeyYBSGDWFUYVLJPZ-UHFFFAOYSA-N
XLogP3.58
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(azepan-2-yl)propan-2-yl]-4-chloroaniline
CID 79553516
ethyl 4-(1-piperidin-2-ylpropan-2-ylamino)benzoate
CID 79537495
N-(1-piperidin-2-ylpropan-2-yl)-4-propan-2-yloxyaniline
CID 79549390
4-propan-2-yl-N-(1-pyrrolidin-2-ylpropan-2-yl)aniline
CID 79541004
2-methyl-N-[4-(1-pyrrolidin-2-ylpropan-2-ylamino)phenyl]propanamide
CID 79537703
N-(1-piperidin-2-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)aniline
CID 79537841
N-[1-(4-ethylphenyl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79541259
3-chloro-4-methyl-N-(1-piperidin-2-ylpropan-2-yl)aniline
CID 79549743
N-[1-(azepan-2-yl)propan-2-yl]-3-bromo-4-methylaniline
CID 79559813
2-[4-(1-piperidin-2-ylpropan-2-ylamino)phenoxy]acetamide
CID 79538614
N-methyl-4-(1-pyrrolidin-2-ylpropan-2-ylamino)benzamide
CID 79540902
N-(1-piperidin-2-ylpropan-2-yl)-4-(1,2,4-triazol-1-yl)aniline
CID 79538123

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline?
The IUPAC name of 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline (CID 79549376) is 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline.
What is the SMILES notation for 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline?
The canonical SMILES for 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline is CCc1ccc(NC(C)CC2CCCCN2)cc1.
What is the InChIKey of 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline?
The InChIKey is YBSGDWFUYVLJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-14-7-9-15(10-8-14)18-13(2)12-16-6-4-5-11-17-16/h7-10,13,16-18H,3-6,11-12H2,1-2H3.
What are the key properties of 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline?
4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline has a molecular weight of 246.40 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(1-piperidin-2-ylpropan-2-yl)aniline is sourced from PubChem (CID 79549376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).