1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide

C14H26N4O3 — CID 63569165

IUPAC1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide
SMILESNNC(=O)C1CCN(C(=O)CN2CCCC(CO)C2)CC1
InChIInChI=1S/C14H26N4O3/c15-16-14(21)12-3-6-18(7-4-12)13(20)9-17-5-1-2-11(8-17)10-19/h11-12,19H,1-10,15H2,(H,16,21)
InChIKeyVLSRKVQVWMJFAH-UHFFFAOYSA-N
MW298.39 g/mol
LogP-1.08
Rot. Bonds4

About 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide

1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide (PubChem CID 63569165) has the molecular formula C14H26N4O3 and a molecular weight of 298.39 g/mol. Its IUPAC name is 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide
PubChem CID63569165
Molecular FormulaC14H26N4O3
Molecular Weight298.39 g/mol
Exact Mass298.20
IUPAC Name1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide
SMILESNNC(=O)C1CCN(C(=O)CN2CCCC(CO)C2)CC1
InChIInChI=1S/C14H26N4O3/c15-16-14(21)12-3-6-18(7-4-12)13(20)9-17-5-1-2-11(8-17)10-19/h11-12,19H,1-10,15H2,(H,16,21)
InChIKeyVLSRKVQVWMJFAH-UHFFFAOYSA-N
XLogP-1.08
TPSA98.90 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 5-1.08
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

1-[2-(4-aminopiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63578248
1-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)acetyl]piperidine-4-carbohydrazide
CID 66372022
1-(2-morpholin-4-ylacetyl)piperidine-4-carbohydrazide
CID 63570302
N-[[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-3-yl]methyl]cyclobutanecarboxamide
CID 131924742
1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63571418
2-[3-(methylaminomethyl)piperidin-1-yl]-1-piperidin-1-ylethanone
CID 61205358
2-(3-aminopiperidin-1-yl)-1-(azepan-1-yl)ethanone
CID 61296313
CID 59303854
CID 59303854
ethyl 4-[3-(hydroxymethyl)piperidin-1-yl]-3-oxobutanoate
CID 63898307
1-[2-(2-oxopiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63578835
1-[2-(3-hydroxypropylsulfanyl)acetyl]piperidine-4-carbohydrazide
CID 66128765
1-(cyclohexylmethyl)piperidine-3-carbohydrazide
CID 45075063

Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide (CID 63569165) is 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide is NNC(=O)C1CCN(C(=O)CN2CCCC(CO)C2)CC1.
What is the InChIKey of 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide?
The InChIKey is VLSRKVQVWMJFAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O3/c15-16-14(21)12-3-6-18(7-4-12)13(20)9-17-5-1-2-11(8-17)10-19/h11-12,19H,1-10,15H2,(H,16,21).
What are the key properties of 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide?
1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide has a molecular weight of 298.39 g/mol, XLogP of -1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63569165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).