N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine

C17H26N4 — CID 103127331

IUPACN-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine
SMILESCCCNC(c1cnn2ccncc12)C1CCC(C)CC1
InChIInChI=1S/C17H26N4/c1-3-8-19-17(14-6-4-13(2)5-7-14)15-11-20-21-10-9-18-12-16(15)21/h9-14,17,19H,3-8H2,1-2H3
InChIKeySVLQPWGLGPEFDT-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.60
Rot. Bonds5

About N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine

N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine (PubChem CID 103127331) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine.

Molecular Properties

Compound NameN-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine
PubChem CID103127331
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC NameN-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine
SMILESCCCNC(c1cnn2ccncc12)C1CCC(C)CC1
InChIInChI=1S/C17H26N4/c1-3-8-19-17(14-6-4-13(2)5-7-14)15-11-20-21-10-9-18-12-16(15)21/h9-14,17,19H,3-8H2,1-2H3
InChIKeySVLQPWGLGPEFDT-UHFFFAOYSA-N
XLogP3.60
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[cyclopentyl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine
CID 103125844
N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine
CID 103127215
N-[(6-methyl-3-pyridinyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine
CID 103127071
N-[(2-chlorophenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine
CID 103126263
N-[(3-chloro-4-pyridinyl)-cyclopropylmethyl]propan-1-amine
CID 105157249
N-ethyl-2-(oxan-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126820
2-cyclopentyl-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126827
N-(1-pyrazolo[1,5-a]pyrazin-3-yl-2-thiophen-2-ylethyl)propan-1-amine
CID 103126662
2-cyclobutyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103128870
N,2-diethyl-1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-amine
CID 103127786
(2-cyclopentyl-1-pyrazolo[1,5-a]pyrazin-3-ylethyl)hydrazine
CID 103129577
N-[(4-methylcyclohexyl)-(3-propyltriazol-4-yl)methyl]propan-1-amine
CID 114687454

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine?
The IUPAC name of N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine (CID 103127331) is N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine.
What is the SMILES notation for N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine?
The canonical SMILES for N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine is CCCNC(c1cnn2ccncc12)C1CCC(C)CC1.
What is the InChIKey of N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine?
The InChIKey is SVLQPWGLGPEFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-3-8-19-17(14-6-4-13(2)5-7-14)15-11-20-21-10-9-18-12-16(15)21/h9-14,17,19H,3-8H2,1-2H3.
What are the key properties of N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine?
N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine has a molecular weight of 286.42 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylcyclohexyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine is sourced from PubChem (CID 103127331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).