2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide

C10H23N3O3 — CID 103229681

IUPAC2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide
SMILESCOCC(C(=O)NN)N(CCCO)C(C)C
InChIInChI=1S/C10H23N3O3/c1-8(2)13(5-4-6-14)9(7-16-3)10(15)12-11/h8-9,14H,4-7,11H2,1-3H3,(H,12,15)
InChIKeyUBNKQWLQGSLAAW-UHFFFAOYSA-N
MW233.31 g/mol
LogP-0.92
Rot. Bonds8

About 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide

2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide (PubChem CID 103229681) has the molecular formula C10H23N3O3 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide.

Molecular Properties

Compound Name2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide
PubChem CID103229681
Molecular FormulaC10H23N3O3
Molecular Weight233.31 g/mol
Exact Mass233.17
IUPAC Name2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide
SMILESCOCC(C(=O)NN)N(CCCO)C(C)C
InChIInChI=1S/C10H23N3O3/c1-8(2)13(5-4-6-14)9(7-16-3)10(15)12-11/h8-9,14H,4-7,11H2,1-3H3,(H,12,15)
InChIKeyUBNKQWLQGSLAAW-UHFFFAOYSA-N
XLogP-0.92
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 5-0.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-[2-hydroxyethyl(methyl)amino]-3-methoxypropanehydrazide
CID 103229552
3-methoxy-2-[methyl(3-methylbutyl)amino]propanehydrazide
CID 103229666
N-carbamoyl-2-[3-hydroxypropyl(propan-2-yl)amino]propanamide
CID 62021615
2-[ethyl(2-methoxyethyl)amino]-3-methoxypropanehydrazide
CID 103229639
3-methoxy-2-[methyl(2-methylpropyl)amino]propanehydrazide
CID 103229498
2-[(2-hydroxy-3-methoxypropyl)-methylamino]-3-methoxypropanehydrazide
CID 103229676
2-[2-methoxyethyl(methyl)amino]pentanehydrazide
CID 83048197
3-methoxy-2-[methyl(2,2,2-trifluoroethyl)amino]propanehydrazide
CID 103229534
2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide
CID 103229508
2-amino-N-[2-[di(propan-2-yl)amino]ethyl]-3-methoxypropanamide
CID 81081227
3-methoxy-2-pentylsulfanylpropanehydrazide
CID 107760948
3-methoxy-2-[methyl-(4-methylcyclohexyl)amino]propanehydrazide
CID 103229662

Frequently Asked Questions

What is the IUPAC name of 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide?
The IUPAC name of 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide (CID 103229681) is 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide.
What is the SMILES notation for 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide?
The canonical SMILES for 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide is COCC(C(=O)NN)N(CCCO)C(C)C.
What is the InChIKey of 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide?
The InChIKey is UBNKQWLQGSLAAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3/c1-8(2)13(5-4-6-14)9(7-16-3)10(15)12-11/h8-9,14H,4-7,11H2,1-3H3,(H,12,15).
What are the key properties of 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide?
2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide has a molecular weight of 233.31 g/mol, XLogP of -0.92, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-hydroxypropyl(propan-2-yl)amino]-3-methoxypropanehydrazide is sourced from PubChem (CID 103229681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).