N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine

C14H21N5 — CID 115372794

IUPACN-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine
SMILESCN(c1ccn2nccc2n1)C1CCCCC1CN
InChIInChI=1S/C14H21N5/c1-18(12-5-3-2-4-11(12)10-15)13-7-9-19-14(17-13)6-8-16-19/h6-9,11-12H,2-5,10,15H2,1H3
InChIKeyIACOKYIPEUCNSG-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.68
Rot. Bonds3

About N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine

N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 115372794) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID115372794
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine
SMILESCN(c1ccn2nccc2n1)C1CCCCC1CN
InChIInChI=1S/C14H21N5/c1-18(12-5-3-2-4-11(12)10-15)13-7-9-19-14(17-13)6-8-16-19/h6-9,11-12H,2-5,10,15H2,1H3
InChIKeyIACOKYIPEUCNSG-UHFFFAOYSA-N
XLogP1.68
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N',2-dimethyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372172
N'-ethyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
CID 115373260
3-[cyclopropyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]propanethioamide
CID 115372209
N-[2-(aminomethyl)cyclohexyl]-N,5,6-trimethyl-1,2,4-triazin-3-amine
CID 114787149
2-methyl-3-[methyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]propanethioamide
CID 113296606
N-[2-(aminomethyl)cyclohexyl]-N-methyl-2,1-benzothiazol-3-amine
CID 66353624
methyl 2-[(2-methoxy-2-oxoethyl)-pyrazolo[1,5-a]pyrimidin-5-ylamino]acetate
CID 115372990
4-[methyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]benzonitrile
CID 115372193
2-(aminomethyl)-N-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114556378
2-[2-[methyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]ethoxy]ethanol
CID 114243521
2-(aminomethyl)-N-cyclopentyl-N-methylcyclopentan-1-amine
CID 43293690
cis-(1R,2S)-2-[[(4-pyrazolo[1,5-a]pyrimidin-5-ylpyrimidin-2-yl)amino]methyl]cyclohexan-1-ol
CID 170278821

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine (CID 115372794) is N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine is CN(c1ccn2nccc2n1)C1CCCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is IACOKYIPEUCNSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-18(12-5-3-2-4-11(12)10-15)13-7-9-19-14(17-13)6-8-16-19/h6-9,11-12H,2-5,10,15H2,1H3.
What are the key properties of N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine?
N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 259.36 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]-N-methylpyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 115372794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).