N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine

C19H40N2 — CID 83046317

IUPACN-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine
SMILESCCCC1CCCCN1CC(C)(CCC)CNC(C)(C)C
InChIInChI=1S/C19H40N2/c1-7-11-17-12-9-10-14-21(17)16-19(6,13-8-2)15-20-18(3,4)5/h17,20H,7-16H2,1-6H3
InChIKeyQUYJUAWTQRDAOR-UHFFFAOYSA-N
MW296.54 g/mol
LogP4.84
Rot. Bonds8

About N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine

N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine (PubChem CID 83046317) has the molecular formula C19H40N2 and a molecular weight of 296.54 g/mol. Its IUPAC name is N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine
PubChem CID83046317
Molecular FormulaC19H40N2
Molecular Weight296.54 g/mol
Exact Mass296.32
IUPAC NameN-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine
SMILESCCCC1CCCCN1CC(C)(CCC)CNC(C)(C)C
InChIInChI=1S/C19H40N2/c1-7-11-17-12-9-10-14-21(17)16-19(6,13-8-2)15-20-18(3,4)5/h17,20H,7-16H2,1-6H3
InChIKeyQUYJUAWTQRDAOR-UHFFFAOYSA-N
XLogP4.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.54
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2,2-dimethyl-3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83061844
2-[1-[2-methyl-2-[(propan-2-ylamino)methyl]pentyl]piperidin-2-yl]ethanol
CID 62261558
2-methyl-2-[(2-propylpiperidin-1-yl)methyl]butan-1-amine
CID 83055635
2-[1-[3-(tert-butylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol
CID 55051425
2,2-dimethyl-3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83056263
2-[(2-ethylazepan-1-yl)methyl]-2-methylpentan-1-ol
CID 113441966
N-tert-butyl-2-methyl-2-[(3-methylmorpholin-4-yl)methyl]pentan-1-amine
CID 62257332
2-(2-azabicyclo[2.2.1]heptan-2-ylmethyl)-N-tert-butyl-2-methylpentan-1-amine
CID 62260271
[1-[2-methyl-2-(propylaminomethyl)pentyl]pyrrolidin-2-yl]methanol
CID 62260314
N-tert-butyl-3-(2-ethylpyrrolidin-1-yl)-2,2-dimethylpropan-1-amine
CID 62278344
3,3-dimethyl-1-(2-propylpiperidin-1-yl)butan-2-ol
CID 83061736
N-tert-butyl-2-methyl-2-[(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methyl]pentan-1-amine
CID 102886565

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine?
The IUPAC name of N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine (CID 83046317) is N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine.
What is the SMILES notation for N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine?
The canonical SMILES for N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine is CCCC1CCCCN1CC(C)(CCC)CNC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine?
The InChIKey is QUYJUAWTQRDAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40N2/c1-7-11-17-12-9-10-14-21(17)16-19(6,13-8-2)15-20-18(3,4)5/h17,20H,7-16H2,1-6H3.
What are the key properties of N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine?
N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine has a molecular weight of 296.54 g/mol, XLogP of 4.84, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-methyl-2-[(2-propylpiperidin-1-yl)methyl]pentan-1-amine is sourced from PubChem (CID 83046317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).