3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine

C12H20N4 — CID 105233187

IUPAC3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCC1CCC(C(NN)c2cccnc2N)C1
InChIInChI=1S/C12H20N4/c1-8-4-5-9(7-8)11(16-14)10-3-2-6-15-12(10)13/h2-3,6,8-9,11,16H,4-5,7,14H2,1H3,(H2,13,15)
InChIKeyDRCCXACNHRDPGE-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.60
Rot. Bonds3

About 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine

3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine (PubChem CID 105233187) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine
PubChem CID105233187
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine
SMILESCC1CCC(C(NN)c2cccnc2N)C1
InChIInChI=1S/C12H20N4/c1-8-4-5-9(7-8)11(16-14)10-3-2-6-15-12(10)13/h2-3,6,8-9,11,16H,4-5,7,14H2,1H3,(H2,13,15)
InChIKeyDRCCXACNHRDPGE-UHFFFAOYSA-N
XLogP1.60
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine?
The IUPAC name of 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine (CID 105233187) is 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine is CC1CCC(C(NN)c2cccnc2N)C1.
What is the InChIKey of 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine?
The InChIKey is DRCCXACNHRDPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-8-4-5-9(7-8)11(16-14)10-3-2-6-15-12(10)13/h2-3,6,8-9,11,16H,4-5,7,14H2,1H3,(H2,13,15).
What are the key properties of 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine?
3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 1.60, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[hydrazinyl-(3-methylcyclopentyl)methyl]pyridin-2-amine is sourced from PubChem (CID 105233187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).