2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine

C14H26N4 — CID 83007008

IUPAC2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine
SMILESCc1nn(C)c(C)c1CNN1C(C)CCCC1C
InChIInChI=1S/C14H26N4/c1-10-7-6-8-11(2)18(10)15-9-14-12(3)16-17(5)13(14)4/h10-11,15H,6-9H2,1-5H3
InChIKeyZERBJIRVLUJQFB-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.30
Rot. Bonds3

About 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine

2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine (PubChem CID 83007008) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine
PubChem CID83007008
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine
SMILESCc1nn(C)c(C)c1CNN1C(C)CCCC1C
InChIInChI=1S/C14H26N4/c1-10-7-6-8-11(2)18(10)15-9-14-12(3)16-17(5)13(14)4/h10-11,15H,6-9H2,1-5H3
InChIKeyZERBJIRVLUJQFB-UHFFFAOYSA-N
XLogP2.30
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2,6-dimethylpiperidin-1-amine
CID 83021984
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-2,6-dimethylpiperidin-1-amine
CID 83009426
N-[(1,3,5-trimethylpyrazol-4-yl)methyl]oxan-3-amine
CID 63359786
1,1-dioxo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]thian-4-amine
CID 43614829
5-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-4,5-dihydro-1H-imidazol-2-amine
CID 120971025
2-(4-methylpiperidin-1-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine
CID 61239722
2,6-dimethyl-N-[(3-methylimidazol-4-yl)methyl]piperidin-1-amine
CID 83007117
N-[[4-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]phenyl]methyl]-2,6-dimethylpiperidin-1-amine
CID 24896833
1-piperidin-2-yl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]methanamine
CID 106634107
1-(oxolan-2-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]methanamine
CID 43180702
1-cyclopropyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine
CID 79225182
(3R)-1-(cyclopentylmethyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-3-amine
CID 97337709

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine (CID 83007008) is 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine is Cc1nn(C)c(C)c1CNN1C(C)CCCC1C.
What is the InChIKey of 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine?
The InChIKey is ZERBJIRVLUJQFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-10-7-6-8-11(2)18(10)15-9-14-12(3)16-17(5)13(14)4/h10-11,15H,6-9H2,1-5H3.
What are the key properties of 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine?
2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine has a molecular weight of 250.39 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-amine is sourced from PubChem (CID 83007008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).