N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide

C12H25N3O — CID 4143849

IUPACN'-butan-2-yl-3-piperidin-1-ylpropanehydrazide
SMILESCCC(C)NNC(=O)CCN1CCCCC1
InChIInChI=1S/C12H25N3O/c1-3-11(2)13-14-12(16)7-10-15-8-5-4-6-9-15/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyVXTPYHKDDSXRGL-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.28
Rot. Bonds6

About N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide

N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide (PubChem CID 4143849) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide.

Molecular Properties

Compound NameN'-butan-2-yl-3-piperidin-1-ylpropanehydrazide
PubChem CID4143849
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN'-butan-2-yl-3-piperidin-1-ylpropanehydrazide
SMILESCCC(C)NNC(=O)CCN1CCCCC1
InChIInChI=1S/C12H25N3O/c1-3-11(2)13-14-12(16)7-10-15-8-5-4-6-9-15/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyVXTPYHKDDSXRGL-UHFFFAOYSA-N
XLogP1.28
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methylbutyl)-3-pyrrolidin-1-ylpropanamide
CID 110688182
N-(2-ethylbutyl)-3-pyrrolidin-1-ylpropanamide
CID 115650073
2-[3-(azepan-1-yl)propanoylamino]-4-methylpentanoic acid
CID 52983772
3-piperidin-1-yl-N-propylpropanamide
CID 110688262
N-methyl-3-pyrrolidin-1-ylpropanamide
CID 20700879
N-ethyl-3-piperidin-1-ylpropanamide;oxalic acid
CID 122170238
2-(butan-2-ylamino)-N-(3-piperidin-1-ylpropyl)acetamide
CID 60852471
N-(2-methylbutan-2-yl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 24842768
N-butan-2-yl-3-(4-methylpiperidin-1-yl)propanamide
CID 109012920
N-(2-methylpropyl)-6-piperidin-1-ylhexanamide
CID 57093766
2-[3-(azepan-1-yl)propanoylamino]acetic acid
CID 52983762
3-(azocan-1-yl)-N-(1-pyridin-4-ylpropan-2-yl)propanamide
CID 46998770

Frequently Asked Questions

What is the IUPAC name of N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide?
The IUPAC name of N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide (CID 4143849) is N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide.
What is the SMILES notation for N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide?
The canonical SMILES for N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide is CCC(C)NNC(=O)CCN1CCCCC1.
What is the InChIKey of N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide?
The InChIKey is VXTPYHKDDSXRGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-3-11(2)13-14-12(16)7-10-15-8-5-4-6-9-15/h11,13H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide?
N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide has a molecular weight of 227.35 g/mol, XLogP of 1.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butan-2-yl-3-piperidin-1-ylpropanehydrazide is sourced from PubChem (CID 4143849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).