4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide

C13H16N4O — CID 63375107

IUPAC4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide
SMILESCC(C)NC(=O)c1cc(NN)c2ccccc2n1
InChIInChI=1S/C13H16N4O/c1-8(2)15-13(18)12-7-11(17-14)9-5-3-4-6-10(9)16-12/h3-8H,14H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyNJFVCGUUDFOJDH-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.66
Rot. Bonds3

About 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide

4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide (PubChem CID 63375107) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide
PubChem CID63375107
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide
SMILESCC(C)NC(=O)c1cc(NN)c2ccccc2n1
InChIInChI=1S/C13H16N4O/c1-8(2)15-13(18)12-7-11(17-14)9-5-3-4-6-10(9)16-12/h3-8H,14H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyNJFVCGUUDFOJDH-UHFFFAOYSA-N
XLogP1.66
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.66
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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Related Compounds

N-hexan-3-yl-4-hydrazinylquinoline-2-carboxamide
CID 63375019
N-butan-2-yl-4-(ethylamino)quinoline-2-carboxamide
CID 63377555
4-hydrazinyl-N,N-dipropylquinoline-2-carboxamide
CID 63375200
4-hydrazinyl-N-(3,3,3-trifluoropropyl)quinoline-2-carboxamide
CID 63375657
N-(1-cyclopropylethyl)-4-hydrazinyl-N-methylquinoline-2-carboxamide
CID 63375607
(4-hydrazinylquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone
CID 63375198
4-hydrazinyl-N-pyrazin-2-ylquinoline-2-carboxamide
CID 63375558
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)quinoline-2-carboxamide
CID 82940781
4-hydrazinyl-N-(thiophen-2-ylmethyl)quinoline-2-carboxamide
CID 63375383
4-amino-N-(4-methylpentan-2-yl)quinoline-2-carboxamide
CID 63375215
(4-hydrazinylquinolin-2-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 63375065
4-hydrazinyl-N-methyl-N-pentylquinoline-2-carboxamide
CID 63375517

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide?
The IUPAC name of 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide (CID 63375107) is 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide is CC(C)NC(=O)c1cc(NN)c2ccccc2n1.
What is the InChIKey of 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide?
The InChIKey is NJFVCGUUDFOJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-8(2)15-13(18)12-7-11(17-14)9-5-3-4-6-10(9)16-12/h3-8H,14H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide?
4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide has a molecular weight of 244.30 g/mol, XLogP of 1.66, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-propan-2-ylquinoline-2-carboxamide is sourced from PubChem (CID 63375107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).