N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine

C10H18N4 — CID 82881493

IUPACN-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine
SMILESCn1ccc(CNC2CCNCC2)n1
InChIInChI=1S/C10H18N4/c1-14-7-4-10(13-14)8-12-9-2-5-11-6-3-9/h4,7,9,11-12H,2-3,5-6,8H2,1H3
InChIKeyUPNQUETZTCNFNG-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.26
Rot. Bonds3

About N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine

N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine (PubChem CID 82881493) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine
PubChem CID82881493
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine
SMILESCn1ccc(CNC2CCNCC2)n1
InChIInChI=1S/C10H18N4/c1-14-7-4-10(13-14)8-12-9-2-5-11-6-3-9/h4,7,9,11-12H,2-3,5-6,8H2,1H3
InChIKeyUPNQUETZTCNFNG-UHFFFAOYSA-N
XLogP0.26
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol
CID 103753154
N-[(1-methylpyrazol-3-yl)methyl]-1-oxothian-4-amine
CID 82881570
1-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1,3-diamine
CID 82882921
3-methoxy-N-[(1-methylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 115320188
N-[(1-methylpyrazol-3-yl)methyl]-5-oxaspiro[3.5]nonan-8-amine
CID 81434408
3-N,3-N-dimethyl-1-N-[(1-methylpyrazol-3-yl)methyl]cyclopentane-1,3-diamine
CID 115881332
N-[(1-methylpyrazol-3-yl)methyl]-1-azabicyclo[2.2.2]octan-3-amine
CID 82866707
2-[(1-methylpyrazol-3-yl)methylamino]cyclohexan-1-ol
CID 78967242
3-(4-chlorophenyl)-N-[(1-methylpyrazol-3-yl)methyl]cyclobutan-1-amine
CID 82882566
N-[(1-methylpyrazol-3-yl)methyl]-6-oxa-2-thiaspiro[4.5]decan-9-amine
CID 81455044
N-[3-methyl-4-(1-methylpyrazol-3-yl)butyl]cyclopropanamine
CID 82882697
N-[(2-methyltriazol-4-yl)methyl]pyrrolidin-3-amine
CID 118390239

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine?
The IUPAC name of N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine (CID 82881493) is N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine.
What is the SMILES notation for N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine?
The canonical SMILES for N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine is Cn1ccc(CNC2CCNCC2)n1.
What is the InChIKey of N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine?
The InChIKey is UPNQUETZTCNFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-14-7-4-10(13-14)8-12-9-2-5-11-6-3-9/h4,7,9,11-12H,2-3,5-6,8H2,1H3.
What are the key properties of N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine?
N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine has a molecular weight of 194.28 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrazol-3-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 82881493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).