6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine

C14H17N5O2 — CID 80904081

IUPAC6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine
SMILESCCC(Nc1nc(NN)ccc1[N+](=O)[O-])c1ccccc1
InChIInChI=1S/C14H17N5O2/c1-2-11(10-6-4-3-5-7-10)16-14-12(19(20)21)8-9-13(17-14)18-15/h3-9,11H,2,15H2,1H3,(H2,16,17,18)
InChIKeyLNPNCZLAQAXSBO-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.84
Rot. Bonds6

About 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine

6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine (PubChem CID 80904081) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine
PubChem CID80904081
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine
SMILESCCC(Nc1nc(NN)ccc1[N+](=O)[O-])c1ccccc1
InChIInChI=1S/C14H17N5O2/c1-2-11(10-6-4-3-5-7-10)16-14-12(19(20)21)8-9-13(17-14)18-15/h3-9,11H,2,15H2,1H3,(H2,16,17,18)
InChIKeyLNPNCZLAQAXSBO-UHFFFAOYSA-N
XLogP2.84
TPSA106.11 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

6-hydrazinyl-N-(4-methylhexan-2-yl)-3-nitropyridin-2-amine
CID 80924578
N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
N-ethyl-2-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]propanamide
CID 80898006
2-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]-3-methoxypropan-1-ol
CID 106198965
2-N-(6-hydrazinyl-3-nitro-2-pyridinyl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 80897107
N-(2,2-dimethylbutyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 103466734
N-(2-ethoxyphenyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 80911491
1-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]-2-methylbutan-2-ol
CID 80916085
2-ethyl-2-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]butan-1-ol
CID 80918744
6-hydrazinyl-N-(3-methylsulfanylpropyl)-3-nitropyridin-2-amine
CID 80912104
6-N-ethyl-3-nitro-2-N-propan-2-ylpyridine-2,6-diamine
CID 80765185
6-hydrazinyl-2-methyl-N-(1-phenylpropyl)pyrimidin-4-amine
CID 80908283

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine?
The IUPAC name of 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine (CID 80904081) is 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine.
What is the SMILES notation for 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine?
The canonical SMILES for 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine is CCC(Nc1nc(NN)ccc1[N+](=O)[O-])c1ccccc1.
What is the InChIKey of 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine?
The InChIKey is LNPNCZLAQAXSBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-2-11(10-6-4-3-5-7-10)16-14-12(19(20)21)8-9-13(17-14)18-15/h3-9,11H,2,15H2,1H3,(H2,16,17,18).
What are the key properties of 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine?
6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine has a molecular weight of 287.32 g/mol, XLogP of 2.84, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-3-nitro-N-(1-phenylpropyl)pyridin-2-amine is sourced from PubChem (CID 80904081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).