N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride

C15H28ClN5O2 — CID 119917197

IUPACN-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride
SMILESCC(C)(C)c1nc(CN2CCCC(C(=O)NCCN)C2)no1.Cl
InChIInChI=1S/C15H27N5O2.ClH/c1-15(2,3)14-18-12(19-22-14)10-20-8-4-5-11(9-20)13(21)17-7-6-16;/h11H,4-10,16H2,1-3H3,(H,17,21);1H
InChIKeyOCHQOKAOIGDLJS-UHFFFAOYSA-N
MW345.88 g/mol
LogP1.08
Rot. Bonds5

About N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride

N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride (PubChem CID 119917197) has the molecular formula C15H28ClN5O2 and a molecular weight of 345.88 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride
PubChem CID119917197
Molecular FormulaC15H28ClN5O2
Molecular Weight345.88 g/mol
Exact Mass345.19
IUPAC NameN-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride
SMILESCC(C)(C)c1nc(CN2CCCC(C(=O)NCCN)C2)no1.Cl
InChIInChI=1S/C15H27N5O2.ClH/c1-15(2,3)14-18-12(19-22-14)10-20-8-4-5-11(9-20)13(21)17-7-6-16;/h11H,4-10,16H2,1-3H3,(H,17,21);1H
InChIKeyOCHQOKAOIGDLJS-UHFFFAOYSA-N
XLogP1.08
TPSA97.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.88
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride with MolForge

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Related Compounds

N-(2-aminoethyl)-1-[(4,6-diamino-1,3,5-triazin-2-yl)methyl]piperidine-3-carboxamide
CID 63253060
1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]-N-methylpiperidin-3-amine;hydrochloride
CID 119920036
2-[1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]acetic acid
CID 62690798
1-[1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]-N-methylmethanamine;hydrochloride
CID 119914755
N-(2-aminoethyl)-1-[(4-ethylphenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119917061
N-(2-aminoethyl)-1-[(4-chlorophenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119916653
N-(2-aminoethyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide
CID 63251974
N-[[(3S)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methyl]methanesulfonamide
CID 94032700
N-(2-aminoethyl)-1-[(2,6-dichlorophenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119916674
N-(2-aminoethyl)-1-[(1-methylpyrazol-3-yl)methyl]piperidine-3-carboxamide
CID 82869536
tert-butyl 2-[3-(2-aminoethylcarbamoyl)piperidin-1-yl]acetate
CID 63253049
1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-4-amine;hydrochloride
CID 119908645

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride (CID 119917197) is N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride is CC(C)(C)c1nc(CN2CCCC(C(=O)NCCN)C2)no1.Cl.
What is the InChIKey of N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride?
The InChIKey is OCHQOKAOIGDLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O2.ClH/c1-15(2,3)14-18-12(19-22-14)10-20-8-4-5-11(9-20)13(21)17-7-6-16;/h11H,4-10,16H2,1-3H3,(H,17,21);1H.
What are the key properties of N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride?
N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride has a molecular weight of 345.88 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-[(5-tert-butyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119917197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).