3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide

C11H23N3O2 — CID 102873681

IUPAC3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide
SMILESCC(CN(CCCO)C1CCC1)C(=O)NN
InChIInChI=1S/C11H23N3O2/c1-9(11(16)13-12)8-14(6-3-7-15)10-4-2-5-10/h9-10,15H,2-8,12H2,1H3,(H,13,16)
InChIKeyNMWBGRLPGXXRJF-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.15
Rot. Bonds7

About 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide

3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide (PubChem CID 102873681) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide.

Molecular Properties

Compound Name3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide
PubChem CID102873681
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide
SMILESCC(CN(CCCO)C1CCC1)C(=O)NN
InChIInChI=1S/C11H23N3O2/c1-9(11(16)13-12)8-14(6-3-7-15)10-4-2-5-10/h9-10,15H,2-8,12H2,1H3,(H,13,16)
InChIKeyNMWBGRLPGXXRJF-UHFFFAOYSA-N
XLogP-0.15
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[cyclopropyl(2-methoxyethyl)amino]-2-methylpropanehydrazide
CID 63583449
2-[cyclobutyl(3-hydroxypropyl)amino]propanehydrazide
CID 102873675
2-[cyclobutyl(3-hydroxypropyl)amino]butanehydrazide
CID 102873674
6-[cyclobutyl(3-hydroxypropyl)amino]hexanehydrazide
CID 102873673
3-[cycloheptyl(2-hydroxyethyl)amino]-2-methylpropanoic acid
CID 82329620
6-[cyclopentyl(2-methylpropyl)amino]hexan-1-ol
CID 103737867
3-[cyclobutyl(2-hydroxyethyl)amino]-2-methylbutanehydrazide
CID 102873737
3-[cyclobutyl-[3-(ethylamino)propyl]amino]propan-1-ol
CID 102869544
3-[3-carboxypropyl(cycloheptyl)amino]-2-methylpropanoic acid
CID 82330624
4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol
CID 102848477
4-[[cyclobutyl(3-hydroxypropyl)amino]methyl]-5-methylthiophene-2-carbohydrazide
CID 102873667
3-[cycloheptyl(3-hydroxypropyl)amino]propanoic acid
CID 82330129

Frequently Asked Questions

What is the IUPAC name of 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide?
The IUPAC name of 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide (CID 102873681) is 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide.
What is the SMILES notation for 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide?
The canonical SMILES for 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide is CC(CN(CCCO)C1CCC1)C(=O)NN.
What is the InChIKey of 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide?
The InChIKey is NMWBGRLPGXXRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-9(11(16)13-12)8-14(6-3-7-15)10-4-2-5-10/h9-10,15H,2-8,12H2,1H3,(H,13,16).
What are the key properties of 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide?
3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide has a molecular weight of 229.32 g/mol, XLogP of -0.15, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclobutyl(3-hydroxypropyl)amino]-2-methylpropanehydrazide is sourced from PubChem (CID 102873681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).