N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine

C10H17ClN4 — CID 62892236

IUPACN-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine
SMILESCCCN(C)Cc1nc(NN)ccc1Cl
InChIInChI=1S/C10H17ClN4/c1-3-6-15(2)7-9-8(11)4-5-10(13-9)14-12/h4-5H,3,6-7,12H2,1-2H3,(H,13,14)
InChIKeyMQCFXCVJRIKAQS-UHFFFAOYSA-N
MW228.73 g/mol
LogP1.86
Rot. Bonds5

About N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine

N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine (PubChem CID 62892236) has the molecular formula C10H17ClN4 and a molecular weight of 228.73 g/mol. Its IUPAC name is N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine.

Molecular Properties

Compound NameN-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine
PubChem CID62892236
Molecular FormulaC10H17ClN4
Molecular Weight228.73 g/mol
Exact Mass228.11
IUPAC NameN-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine
SMILESCCCN(C)Cc1nc(NN)ccc1Cl
InChIInChI=1S/C10H17ClN4/c1-3-6-15(2)7-9-8(11)4-5-10(13-9)14-12/h4-5H,3,6-7,12H2,1-2H3,(H,13,14)
InChIKeyMQCFXCVJRIKAQS-UHFFFAOYSA-N
XLogP1.86
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.73
LogP ≤ 51.86
H-Bond Donors ≤ 52
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 N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine?
The IUPAC name of N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine (CID 62892236) is N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine.
What is the SMILES notation for N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine?
The canonical SMILES for N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine is CCCN(C)Cc1nc(NN)ccc1Cl.
What is the InChIKey of N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine?
The InChIKey is MQCFXCVJRIKAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN4/c1-3-6-15(2)7-9-8(11)4-5-10(13-9)14-12/h4-5H,3,6-7,12H2,1-2H3,(H,13,14).
What are the key properties of N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine?
N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine has a molecular weight of 228.73 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chloro-6-hydrazinyl-2-pyridinyl)methyl]-N-methylpropan-1-amine is sourced from PubChem (CID 62892236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).