2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide

C11H24N4O — CID 63572438

IUPAC2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide
SMILESCC(CN(C)C1CCCN(C)C1)C(=O)NN
InChIInChI=1S/C11H24N4O/c1-9(11(16)13-12)7-15(3)10-5-4-6-14(2)8-10/h9-10H,4-8,12H2,1-3H3,(H,13,16)
InChIKeyDYSQRVVLZNYQQS-UHFFFAOYSA-N
MW228.34 g/mol
LogP-0.36
Rot. Bonds4

About 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide

2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide (PubChem CID 63572438) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide.

Molecular Properties

Compound Name2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide
PubChem CID63572438
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC Name2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide
SMILESCC(CN(C)C1CCCN(C)C1)C(=O)NN
InChIInChI=1S/C11H24N4O/c1-9(11(16)13-12)7-15(3)10-5-4-6-14(2)8-10/h9-10H,4-8,12H2,1-3H3,(H,13,16)
InChIKeyDYSQRVVLZNYQQS-UHFFFAOYSA-N
XLogP-0.36
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
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

methyl 2-amino-3-[methyl-(1-methylpiperidin-3-yl)amino]propanoate
CID 62545953
4-amino-1-[methyl-(1-methylpiperidin-3-yl)amino]butan-2-ol
CID 117039168
2-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]butanedioic acid
CID 115144584
methyl 2-(methylamino)-4-[methyl-(1-methylpiperidin-3-yl)amino]butanoate
CID 63054552
2-methyl-3-[methyl(oxolan-3-yl)amino]propanehydrazide
CID 82754042
1-cyclopentyl-N,N'-dimethyl-N'-(1-methylpiperidin-3-yl)ethane-1,2-diamine
CID 104745946
4-fluoro-3-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]benzohydrazide
CID 107458463
ethyl 3-[methyl-(1-methylpiperidin-3-yl)amino]propanoate
CID 62546082
2-cyclopropyl-3-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propan-2-ylamino)propanamide
CID 63925394
2-[methyl-(1-methylpiperidin-3-yl)amino]propanamide
CID 62900097
1-methoxy-3-[methyl-(1-methylpiperidin-3-yl)amino]propan-2-ol
CID 63930037
methyl 4-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propylamino)butanoate
CID 63054708

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide?
The IUPAC name of 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide (CID 63572438) is 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide.
What is the SMILES notation for 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide?
The canonical SMILES for 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide is CC(CN(C)C1CCCN(C)C1)C(=O)NN.
What is the InChIKey of 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide?
The InChIKey is DYSQRVVLZNYQQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-9(11(16)13-12)7-15(3)10-5-4-6-14(2)8-10/h9-10H,4-8,12H2,1-3H3,(H,13,16).
What are the key properties of 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide?
2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide has a molecular weight of 228.34 g/mol, XLogP of -0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[methyl-(1-methylpiperidin-3-yl)amino]propanehydrazide is sourced from PubChem (CID 63572438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).