1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine

C10H18N4 — CID 67113476

IUPAC1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine
SMILESCN1CCCC(Cn2cc(N)cn2)C1
InChIInChI=1S/C10H18N4/c1-13-4-2-3-9(6-13)7-14-8-10(11)5-12-14/h5,8-9H,2-4,6-7,11H2,1H3
InChIKeyZHIVBAWKAMMQIV-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.81
Rot. Bonds2

About 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine

1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine (PubChem CID 67113476) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine
PubChem CID67113476
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine
SMILESCN1CCCC(Cn2cc(N)cn2)C1
InChIInChI=1S/C10H18N4/c1-13-4-2-3-9(6-13)7-14-8-10(11)5-12-14/h5,8-9H,2-4,6-7,11H2,1H3
InChIKeyZHIVBAWKAMMQIV-UHFFFAOYSA-N
XLogP0.81
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Ethyl-1h-pyrazol-4-amine
CID 7018640
1-[2-(diethylamino)ethyl]-1H-pyrazol-4-amine
CID 42281880
N-methyl-1-[2-(1H-pyrazol-1-yl)ethyl]piperidin-4-amine
CID 50989058
1-(2-methylpropyl)-1H-pyrazol-4-amine
CID 17856047
1-propyl-1H-pyrazol-4-amine
CID 19620834
1-(cyclopropylmethyl)-1H-pyrazol-4-amine
CID 43560372
1-(2,2-dimethylpropyl)-1H-pyrazol-4-amine
CID 51000375
1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine
CID 54593547
1-(1-methyl-1H-pyrazol-4-yl)piperazine
CID 56828582
1-(1-cyclopropylethyl)-1H-pyrazol-4-amine
CID 61272898
N-methyl-1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine
CID 64270757
1-(cyclobutylmethyl)-1H-pyrazol-4-amine
CID 64985324

Frequently Asked Questions

What is the IUPAC name of 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine?
The IUPAC name of 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine (CID 67113476) is 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine.
What is the SMILES notation for 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine?
The canonical SMILES for 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine is CN1CCCC(Cn2cc(N)cn2)C1.
What is the InChIKey of 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine?
The InChIKey is ZHIVBAWKAMMQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-13-4-2-3-9(6-13)7-14-8-10(11)5-12-14/h5,8-9H,2-4,6-7,11H2,1H3.
What are the key properties of 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine?
1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine has a molecular weight of 194.28 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-methylpiperidin-3-yl)methyl]pyrazol-4-amine is sourced from PubChem (CID 67113476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).