N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine

C15H32N2 — CID 166564812

IUPACN-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)CNCN1CCC(C(C)(C)C)CC1
InChIInChI=1S/C15H32N2/c1-14(2,3)11-16-12-17-9-7-13(8-10-17)15(4,5)6/h13,16H,7-12H2,1-6H3
InChIKeySVDWKZUZUUBXEQ-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.34
Rot. Bonds3

About N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine

N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine (PubChem CID 166564812) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine
PubChem CID166564812
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)CNCN1CCC(C(C)(C)C)CC1
InChIInChI=1S/C15H32N2/c1-14(2,3)11-16-12-17-9-7-13(8-10-17)15(4,5)6/h13,16H,7-12H2,1-6H3
InChIKeySVDWKZUZUUBXEQ-UHFFFAOYSA-N
XLogP3.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-tert-butylpiperidin-1-yl)methylphosphane
CID 131973586
N-[(4-tert-butylcyclohexyl)methyl]-2,2-dimethylpropan-1-amine
CID 104574982
N-[2-(4-tert-butylpiperidin-1-yl)ethyl]-2,2,2-trifluoroethanamine
CID 62559376
4-tert-butyl-1-(2,2,2-trifluoroethyl)piperidine
CID 59416758
CID 174080990
CID 174080990
1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine
CID 62089869
4-tert-butyl-1-[[1-(2,2-dimethylpropyl)piperidin-4-yl]methyl]piperidine
CID 160513190
4-(4-tert-butylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64787040
4-(4-tert-butylpiperidin-1-yl)-N-methylbutan-1-amine
CID 62084191
N-[3-(4-tert-butylpiperidin-1-yl)propyl]-2-methylpropan-2-amine
CID 62091294
1-tert-butyl-4-[(4-tert-butylpiperidin-1-yl)methyl]piperazine
CID 134335583
3-(4-tert-butylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)propan-1-ol
CID 64787038

Frequently Asked Questions

What is the IUPAC name of N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine?
The IUPAC name of N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine (CID 166564812) is N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine is CC(C)(C)CNCN1CCC(C(C)(C)C)CC1.
What is the InChIKey of N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine?
The InChIKey is SVDWKZUZUUBXEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-14(2,3)11-16-12-17-9-7-13(8-10-17)15(4,5)6/h13,16H,7-12H2,1-6H3.
What are the key properties of N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine?
N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine has a molecular weight of 240.43 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-tert-butylpiperidin-1-yl)methyl]-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 166564812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).