N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide

C14H22N4O — CID 95561922

IUPACN'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide
SMILESC[C@@H](CN1CCCCC1)NNC(=O)c1ccncc1
InChIInChI=1S/C14H22N4O/c1-12(11-18-9-3-2-4-10-18)16-17-14(19)13-5-7-15-8-6-13/h5-8,12,16H,2-4,9-11H2,1H3,(H,17,19)/t12-/m0/s1
InChIKeyQVTJOZWJNPSWIG-LBPRGKRZSA-N
MW262.36 g/mol
LogP1.19
Rot. Bonds5

About N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide

N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide (PubChem CID 95561922) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide.

Molecular Properties

Compound NameN'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide
PubChem CID95561922
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide
SMILESC[C@@H](CN1CCCCC1)NNC(=O)c1ccncc1
InChIInChI=1S/C14H22N4O/c1-12(11-18-9-3-2-4-10-18)16-17-14(19)13-5-7-15-8-6-13/h5-8,12,16H,2-4,9-11H2,1H3,(H,17,19)/t12-/m0/s1
InChIKeyQVTJOZWJNPSWIG-LBPRGKRZSA-N
XLogP1.19
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide
CID 27512
2-chloro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 61217354
N'-(azepane-1-carbothioyl)pyridine-4-carbohydrazide
CID 1280738
N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]pyridine-4-carboxamide
CID 110347461
2-(ethylamino)-N-(1-piperidin-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 62176247
4-oxo-3-(piperidin-1-ylmethyl)-4-pyridin-4-ylbutanoic acid
CID 22467013
3-(methylamino)-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 105069457
N-(1-piperidin-1-ylpropan-2-yl)-4-propan-2-ylsulfanylbenzamide
CID 112841502
N'-(cyclohexanecarbonyl)pyridine-4-carbohydrazide
CID 782647
3,5-dihydroxy-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 107703759
6-bromo-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-3-carboxamide
CID 66464130
4-(ethylamino)-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-3-carboxamide
CID 81240259

Frequently Asked Questions

What is the IUPAC name of N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide?
The IUPAC name of N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide (CID 95561922) is N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide.
What is the SMILES notation for N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide?
The canonical SMILES for N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide is C[C@@H](CN1CCCCC1)NNC(=O)c1ccncc1.
What is the InChIKey of N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide?
The InChIKey is QVTJOZWJNPSWIG-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H22N4O/c1-12(11-18-9-3-2-4-10-18)16-17-14(19)13-5-7-15-8-6-13/h5-8,12,16H,2-4,9-11H2,1H3,(H,17,19)/t12-/m0/s1.
What are the key properties of N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide?
N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide has a molecular weight of 262.36 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide is sourced from PubChem (CID 95561922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).