1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine

C15H28N4 — CID 106757617

IUPAC1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine
SMILESCC(NC1CCN(C(C)(C)C)CC1)c1ccnn1C
InChIInChI=1S/C15H28N4/c1-12(14-6-9-16-18(14)5)17-13-7-10-19(11-8-13)15(2,3)4/h6,9,12-13,17H,7-8,10-11H2,1-5H3
InChIKeyPKBUKCOGHZCPCI-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.33
Rot. Bonds3

About 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine

1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine (PubChem CID 106757617) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine
PubChem CID106757617
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine
SMILESCC(NC1CCN(C(C)(C)C)CC1)c1ccnn1C
InChIInChI=1S/C15H28N4/c1-12(14-6-9-16-18(14)5)17-13-7-10-19(11-8-13)15(2,3)4/h6,9,12-13,17H,7-8,10-11H2,1-5H3
InChIKeyPKBUKCOGHZCPCI-UHFFFAOYSA-N
XLogP2.33
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-methylpyrazol-3-yl)ethyl]oxan-4-amine
CID 106757083
1-cyclopropyl-N-[1-(2-methylpyrazol-3-yl)ethyl]pyrrolidin-3-amine
CID 106757719
4-ethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]cyclohexan-1-amine
CID 106757689
N-[1-(2-methylpyrazol-3-yl)ethyl]oxan-3-amine
CID 106757805
1-tert-butyl-N-[1-(4-chlorophenyl)ethyl]piperidin-4-amine
CID 60931192
1-cyclohexyl-N-[1-(2-methylpyrazol-3-yl)ethyl]ethanamine
CID 106757760
N-[2-(1-methylpiperidin-4-yl)ethyl]-1-(2-methylpyrazol-3-yl)ethanamine
CID 106758148
2,4-dimethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]cyclohexan-1-amine
CID 106757824
1-tert-butyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]piperidin-4-amine
CID 54866710
2-methyl-N-[1-(2-methylpyrazol-3-yl)ethyl]-2-morpholin-4-ylpropan-1-amine
CID 106756920
N-(cyclohexylmethyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 106757054
(4R)-4-[[(1R)-1-(2-methylpyrazol-3-yl)ethyl]amino]-1-(2-phenoxyethyl)pyrrolidin-2-one
CID 124625420

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine?
The IUPAC name of 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine (CID 106757617) is 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine?
The canonical SMILES for 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine is CC(NC1CCN(C(C)(C)C)CC1)c1ccnn1C.
What is the InChIKey of 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine?
The InChIKey is PKBUKCOGHZCPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-12(14-6-9-16-18(14)5)17-13-7-10-19(11-8-13)15(2,3)4/h6,9,12-13,17H,7-8,10-11H2,1-5H3.
What are the key properties of 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine?
1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine has a molecular weight of 264.42 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-N-[1-(2-methylpyrazol-3-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 106757617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).