N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine

C13H16N4 — CID 113390879

IUPACN-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
SMILESCn1ccc(CNc2ccc3c(n2)CCC3)n1
InChIInChI=1S/C13H16N4/c1-17-8-7-11(16-17)9-14-13-6-5-10-3-2-4-12(10)15-13/h5-8H,2-4,9H2,1H3,(H,14,15)
InChIKeyGJILABXXIWPMKA-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.92
Rot. Bonds3

About N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine

N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine (PubChem CID 113390879) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine.

Molecular Properties

Compound NameN-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
PubChem CID113390879
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
SMILESCn1ccc(CNc2ccc3c(n2)CCC3)n1
InChIInChI=1S/C13H16N4/c1-17-8-7-11(16-17)9-14-13-6-5-10-3-2-4-12(10)15-13/h5-8H,2-4,9H2,1H3,(H,14,15)
InChIKeyGJILABXXIWPMKA-UHFFFAOYSA-N
XLogP1.92
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methyl-1,3-thiazol-4-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 113390820
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 113390907
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 106303380
N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 82873144
N-[(1-methylpyrazol-3-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 79478733
1-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)propane-1,2-diamine
CID 83829939
6-chloro-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrimidin-4-amine
CID 82873713
N-(3-methylbut-2-enyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 106191346
N-[(3-ethylthiophen-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 113390871
4-[(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylamino)methyl]benzoic acid
CID 122035144
6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile
CID 82873499
6-methoxy-N-[(1-methylpyrazol-3-yl)methyl]pyrazin-2-amine
CID 155403134

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
The IUPAC name of N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine (CID 113390879) is N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine.
What is the SMILES notation for N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
The canonical SMILES for N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine is Cn1ccc(CNc2ccc3c(n2)CCC3)n1.
What is the InChIKey of N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
The InChIKey is GJILABXXIWPMKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-17-8-7-11(16-17)9-14-13-6-5-10-3-2-4-12(10)15-13/h5-8H,2-4,9H2,1H3,(H,14,15).
What are the key properties of N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine?
N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine has a molecular weight of 228.30 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrazol-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine is sourced from PubChem (CID 113390879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).