2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine

C16H34N2 — CID 83200092

IUPAC2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine
SMILESCC(CNCC(C)(C)C1CCCNC1)C(C)(C)C
InChIInChI=1S/C16H34N2/c1-13(15(2,3)4)10-18-12-16(5,6)14-8-7-9-17-11-14/h13-14,17-18H,7-12H2,1-6H3
InChIKeyZQPNLXKKQCGZAZ-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.28
Rot. Bonds5

About 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine

2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine (PubChem CID 83200092) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine.

Molecular Properties

Compound Name2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine
PubChem CID83200092
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine
SMILESCC(CNCC(C)(C)C1CCCNC1)C(C)(C)C
InChIInChI=1S/C16H34N2/c1-13(15(2,3)4)10-18-12-16(5,6)14-8-7-9-17-11-14/h13-14,17-18H,7-12H2,1-6H3
InChIKeyZQPNLXKKQCGZAZ-UHFFFAOYSA-N
XLogP3.28
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-piperidin-3-yl-N-propylpropan-1-amine
CID 83199931
N-(2-methoxyethyl)-2-methyl-2-piperidin-3-ylpropan-1-amine
CID 83199662
N-(2-methyl-2-piperidin-3-ylpropyl)cyclopropanamine
CID 83200198
2-cyclobutyl-2-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 115209786
2-methyl-2-piperidin-3-ylpropan-1-ol
CID 83200214
2-methyl-N-[(2-methyloxolan-2-yl)methyl]-2-piperidin-3-ylpropan-1-amine
CID 83198491
2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine
CID 83199653
(3R)-3-tert-butylpiperidine
CID 59772800
N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine
CID 115252969
2-methyl-N-(2-methylpropyl)-2-piperidin-3-ylpropanamide
CID 83032464
N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
CID 115198967
3-methyl-2-piperidin-3-ylhexan-2-ol
CID 107892565

Frequently Asked Questions

What is the IUPAC name of 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine?
The IUPAC name of 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine (CID 83200092) is 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine.
What is the SMILES notation for 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine?
The canonical SMILES for 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine is CC(CNCC(C)(C)C1CCCNC1)C(C)(C)C.
What is the InChIKey of 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine?
The InChIKey is ZQPNLXKKQCGZAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-13(15(2,3)4)10-18-12-16(5,6)14-8-7-9-17-11-14/h13-14,17-18H,7-12H2,1-6H3.
What are the key properties of 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine?
2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine is sourced from PubChem (CID 83200092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).