1-butyl-2-piperidin-4-ylhydrazine

C9H21N3 — CID 174712334

IUPAC1-butyl-2-piperidin-4-ylhydrazine
SMILESCCCCNNC1CCNCC1
InChIInChI=1S/C9H21N3/c1-2-3-6-11-12-9-4-7-10-8-5-9/h9-12H,2-8H2,1H3
InChIKeyQFKRGCCSWROLLE-UHFFFAOYSA-N
MW171.29 g/mol
LogP0.63
Rot. Bonds5

About 1-butyl-2-piperidin-4-ylhydrazine

1-butyl-2-piperidin-4-ylhydrazine (PubChem CID 174712334) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is 1-butyl-2-piperidin-4-ylhydrazine.

Molecular Properties

Compound Name1-butyl-2-piperidin-4-ylhydrazine
PubChem CID174712334
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC Name1-butyl-2-piperidin-4-ylhydrazine
SMILESCCCCNNC1CCNCC1
InChIInChI=1S/C9H21N3/c1-2-3-6-11-12-9-4-7-10-8-5-9/h9-12H,2-8H2,1H3
InChIKeyQFKRGCCSWROLLE-UHFFFAOYSA-N
XLogP0.63
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(3S)-N-butylpyrrolidin-3-amine
CID 154470800
N-(3-butoxypropyl)piperidin-4-amine
CID 20735437
N-(2-methylnonan-2-yl)piperidin-4-amine
CID 167126912
N-(6-methyltridecan-6-yl)piperidin-4-amine
CID 175625026
N-methylbutan-1-amine;piperidine
CID 143978162
N-piperidin-4-ylhexanamide;hydrochloride
CID 47002713
1-pentadecyl-N-piperidin-4-ylpiperidin-4-amine
CID 11641883
N-(2-ethylheptyl)piperidin-4-amine
CID 69327610
N-(2-methylhexan-2-yl)pyrrolidin-3-amine
CID 139362773
N-(piperidin-4-ylmethyl)pentadecan-1-amine;dihydrochloride
CID 11696932
4-hexadecylpiperidine
CID 54096875
N-(5-ethoxypentyl)piperidin-4-amine
CID 164907072

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-piperidin-4-ylhydrazine?
The IUPAC name of 1-butyl-2-piperidin-4-ylhydrazine (CID 174712334) is 1-butyl-2-piperidin-4-ylhydrazine.
What is the SMILES notation for 1-butyl-2-piperidin-4-ylhydrazine?
The canonical SMILES for 1-butyl-2-piperidin-4-ylhydrazine is CCCCNNC1CCNCC1.
What is the InChIKey of 1-butyl-2-piperidin-4-ylhydrazine?
The InChIKey is QFKRGCCSWROLLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3/c1-2-3-6-11-12-9-4-7-10-8-5-9/h9-12H,2-8H2,1H3.
What are the key properties of 1-butyl-2-piperidin-4-ylhydrazine?
1-butyl-2-piperidin-4-ylhydrazine has a molecular weight of 171.29 g/mol, XLogP of 0.63, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-piperidin-4-ylhydrazine is sourced from PubChem (CID 174712334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).