N-(5-methylpiperidin-3-yl)formamide;hydrochloride

C7H15ClN2O — CID 175089346

IUPACN-(5-methylpiperidin-3-yl)formamide;hydrochloride
SMILESCC1CNCC(NC=O)C1.Cl
InChIInChI=1S/C7H14N2O.ClH/c1-6-2-7(9-5-10)4-8-3-6;/h5-8H,2-4H2,1H3,(H,9,10);1H
InChIKeyHVLGBZUUDQIPHU-UHFFFAOYSA-N
MW178.66 g/mol
LogP0.15
Rot. Bonds2

About N-(5-methylpiperidin-3-yl)formamide;hydrochloride

N-(5-methylpiperidin-3-yl)formamide;hydrochloride (PubChem CID 175089346) has the molecular formula C7H15ClN2O and a molecular weight of 178.66 g/mol. Its IUPAC name is N-(5-methylpiperidin-3-yl)formamide;hydrochloride.

Molecular Properties

Compound NameN-(5-methylpiperidin-3-yl)formamide;hydrochloride
PubChem CID175089346
Molecular FormulaC7H15ClN2O
Molecular Weight178.66 g/mol
Exact Mass178.09
IUPAC NameN-(5-methylpiperidin-3-yl)formamide;hydrochloride
SMILESCC1CNCC(NC=O)C1.Cl
InChIInChI=1S/C7H14N2O.ClH/c1-6-2-7(9-5-10)4-8-3-6;/h5-8H,2-4H2,1H3,(H,9,10);1H
InChIKeyHVLGBZUUDQIPHU-UHFFFAOYSA-N
XLogP0.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.66
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(5-cyanopiperidin-3-yl)formamide
CID 129073915
ethane;N-(3-methylcyclohexyl)formamide
CID 145231025
2-methyl-N-(5-methylpiperidin-3-yl)propanamide
CID 107585162
N-(5-methylpiperidin-3-yl)cyclopropanecarboxamide
CID 173311262
azane;3,5-dimethylpiperidine
CID 23174858
1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea
CID 107585278
ethane;N-piperidin-4-ylformamide
CID 142035291
4-methyl-N-(5-methylpiperidin-3-yl)piperidine-1-sulfonamide
CID 107585361
1-cyclopropyl-N-(5-methylpiperidin-3-yl)methanesulfonamide
CID 107585329
3,3,3-trifluoro-N-(5-methylpiperidin-3-yl)propanamide
CID 107585044
fluoromethane;N-piperidin-4-ylformamide
CID 144898161
2-ethoxy-N-(5-methylpiperidin-3-yl)acetamide
CID 107585189

Frequently Asked Questions

What is the IUPAC name of N-(5-methylpiperidin-3-yl)formamide;hydrochloride?
The IUPAC name of N-(5-methylpiperidin-3-yl)formamide;hydrochloride (CID 175089346) is N-(5-methylpiperidin-3-yl)formamide;hydrochloride.
What is the SMILES notation for N-(5-methylpiperidin-3-yl)formamide;hydrochloride?
The canonical SMILES for N-(5-methylpiperidin-3-yl)formamide;hydrochloride is CC1CNCC(NC=O)C1.Cl.
What is the InChIKey of N-(5-methylpiperidin-3-yl)formamide;hydrochloride?
The InChIKey is HVLGBZUUDQIPHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O.ClH/c1-6-2-7(9-5-10)4-8-3-6;/h5-8H,2-4H2,1H3,(H,9,10);1H.
What are the key properties of N-(5-methylpiperidin-3-yl)formamide;hydrochloride?
N-(5-methylpiperidin-3-yl)formamide;hydrochloride has a molecular weight of 178.66 g/mol, XLogP of 0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylpiperidin-3-yl)formamide;hydrochloride is sourced from PubChem (CID 175089346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).