3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine

C15H28N4 — CID 62659074

IUPAC3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine
SMILESCc1nn(C(C)C)c(C)c1NCC1CCN(C)CC1
InChIInChI=1S/C15H28N4/c1-11(2)19-13(4)15(12(3)17-19)16-10-14-6-8-18(5)9-7-14/h11,14,16H,6-10H2,1-5H3
InChIKeyXYICRXJNTYVRAO-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.83
Rot. Bonds4

About 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine

3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine (PubChem CID 62659074) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine
PubChem CID62659074
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine
SMILESCc1nn(C(C)C)c(C)c1NCC1CCN(C)CC1
InChIInChI=1S/C15H28N4/c1-11(2)19-13(4)15(12(3)17-19)16-10-14-6-8-18(5)9-7-14/h11,14,16H,6-10H2,1-5H3
InChIKeyXYICRXJNTYVRAO-UHFFFAOYSA-N
XLogP2.83
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-Dimethyl-1-(1-methylethyl)-1H-pyrazol-4-amine
CID 3031275
1-[(trimethyl-1H-pyrazol-4-yl)methyl]piperazine
CID 6485353
3-(3,5-dimethyl-1H-pyrazol-1-yl)piperidine
CID 54592912
1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazine
CID 7175809
Sbb010340
CID 6492580
2,3-dimethyl-2H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine
CID 82417238
2-(3,4,5-Trimethylpyrazol-1-yl)propan-1-amine
CID 6492579
N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]ethanamine
CID 23005746
1-Isobutyl-3,5-dimethyl-1H-pyrazol-4-amine
CID 28412411
pentyl[(trimethyl-1H-pyrazol-4-yl)methyl]amine
CID 28612057
1,3-dimethyl-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine dihydrochloride
CID 137951586
1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-tetrahydro-1H-pyrrol-3-ylpiperidine
CID 91921464

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine?
The IUPAC name of 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine (CID 62659074) is 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine.
What is the SMILES notation for 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine?
The canonical SMILES for 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine is Cc1nn(C(C)C)c(C)c1NCC1CCN(C)CC1.
What is the InChIKey of 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine?
The InChIKey is XYICRXJNTYVRAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-11(2)19-13(4)15(12(3)17-19)16-10-14-6-8-18(5)9-7-14/h11,14,16H,6-10H2,1-5H3.
What are the key properties of 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine?
3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine has a molecular weight of 264.42 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-1-propan-2-ylpyrazol-4-amine is sourced from PubChem (CID 62659074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).