N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine

C16H30N4S — CID 126841662

IUPACN-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine
SMILESCCCCN(Cc1csnn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C16H30N4S/c1-6-7-8-20(11-13-12-21-19-17-13)14-9-15(2,3)18-16(4,5)10-14/h12,14,18H,6-11H2,1-5H3
InChIKeyWWPNPYMDPGNODA-UHFFFAOYSA-N
MW310.51 g/mol
LogP3.45
Rot. Bonds6

About N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine

N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine (PubChem CID 126841662) has the molecular formula C16H30N4S and a molecular weight of 310.51 g/mol. Its IUPAC name is N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine
PubChem CID126841662
Molecular FormulaC16H30N4S
Molecular Weight310.51 g/mol
Exact Mass310.22
IUPAC NameN-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine
SMILESCCCCN(Cc1csnn1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C16H30N4S/c1-6-7-8-20(11-13-12-21-19-17-13)14-9-15(2,3)18-16(4,5)10-14/h12,14,18H,6-11H2,1-5H3
InChIKeyWWPNPYMDPGNODA-UHFFFAOYSA-N
XLogP3.45
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.51
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-methylpiperidin-1-yl)-N-(thiadiazol-4-ylmethyl)propan-1-amine
CID 43663877
1-N,1-N-diethyl-4-N-(thiadiazol-4-ylmethyl)pentane-1,4-diamine
CID 43663889
4-methyl-N-(thiadiazol-4-ylmethyl)cyclohexan-1-amine
CID 43663899
2-methyl-N-[(1,2,3-thiadiazol-4-yl)methyl]cyclohexan-1-amine
CID 43663918
N,N-dimethyl-1-[(thiadiazol-4-ylmethylamino)methyl]cyclohexan-1-amine
CID 43663955
N-[(1-piperidin-1-ylcyclohexyl)methyl]-1-(thiadiazol-4-yl)methanamine
CID 43663960
5-methyl-N-(thiadiazol-4-ylmethyl)hexan-2-amine
CID 43663977
(2-Ethylhexyl)[(1,2,3-thiadiazol-4-yl)methyl]amine
CID 43663984
3-(4-methylpiperazin-1-yl)-N-(thiadiazol-4-ylmethyl)propan-1-amine
CID 43663999
3-piperidin-1-yl-N-(thiadiazol-4-ylmethyl)propan-1-amine
CID 43664001
(6-Methylheptan-2-yl)[(1,2,3-thiadiazol-4-yl)methyl]amine
CID 43664025
2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine
CID 43664031

Frequently Asked Questions

What is the IUPAC name of N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine?
The IUPAC name of N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine (CID 126841662) is N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine is CCCCN(Cc1csnn1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine?
The InChIKey is WWPNPYMDPGNODA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4S/c1-6-7-8-20(11-13-12-21-19-17-13)14-9-15(2,3)18-16(4,5)10-14/h12,14,18H,6-11H2,1-5H3.
What are the key properties of N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine?
N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine has a molecular weight of 310.51 g/mol, XLogP of 3.45, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2,2,6,6-tetramethyl-N-(thiadiazol-4-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 126841662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).