1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride

C10H20ClN3O2 — CID 119291566

IUPAC1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC1CCC(C(N)=O)CN1C(=O)CCN.Cl
InChIInChI=1S/C10H19N3O2.ClH/c1-7-2-3-8(10(12)15)6-13(7)9(14)4-5-11;/h7-8H,2-6,11H2,1H3,(H2,12,15);1H
InChIKeyMXDQUGRBTBUWAT-UHFFFAOYSA-N
MW249.74 g/mol
LogP-0.13
Rot. Bonds3

About 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride

1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119291566) has the molecular formula C10H20ClN3O2 and a molecular weight of 249.74 g/mol. Its IUPAC name is 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride
PubChem CID119291566
Molecular FormulaC10H20ClN3O2
Molecular Weight249.74 g/mol
Exact Mass249.12
IUPAC Name1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC1CCC(C(N)=O)CN1C(=O)CCN.Cl
InChIInChI=1S/C10H19N3O2.ClH/c1-7-2-3-8(10(12)15)6-13(7)9(14)4-5-11;/h7-8H,2-6,11H2,1H3,(H2,12,15);1H
InChIKeyMXDQUGRBTBUWAT-UHFFFAOYSA-N
XLogP-0.13
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride (CID 119291566) is 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride is CC1CCC(C(N)=O)CN1C(=O)CCN.Cl.
What is the InChIKey of 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is MXDQUGRBTBUWAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2.ClH/c1-7-2-3-8(10(12)15)6-13(7)9(14)4-5-11;/h7-8H,2-6,11H2,1H3,(H2,12,15);1H.
What are the key properties of 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride?
1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 249.74 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119291566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).