N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride

C17H25ClN2O3 — CID 119762199

IUPACN-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)NCC2CCOc3ccccc32)CCNCC1.Cl
InChIInChI=1S/C17H24N2O3.ClH/c1-21-17(7-9-18-10-8-17)16(20)19-12-13-6-11-22-15-5-3-2-4-14(13)15;/h2-5,13,18H,6-12H2,1H3,(H,19,20);1H
InChIKeyZJZYRFXSJMJYLV-UHFFFAOYSA-N
MW340.85 g/mol
LogP1.86
Rot. Bonds4

About N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride

N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride (PubChem CID 119762199) has the molecular formula C17H25ClN2O3 and a molecular weight of 340.85 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
PubChem CID119762199
Molecular FormulaC17H25ClN2O3
Molecular Weight340.85 g/mol
Exact Mass340.16
IUPAC NameN-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)NCC2CCOc3ccccc32)CCNCC1.Cl
InChIInChI=1S/C17H24N2O3.ClH/c1-21-17(7-9-18-10-8-17)16(20)19-12-13-6-11-22-15-5-3-2-4-14(13)15;/h2-5,13,18H,6-12H2,1H3,(H,19,20);1H
InChIKeyZJZYRFXSJMJYLV-UHFFFAOYSA-N
XLogP1.86
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.85
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dihydro-2H-chromen-4-ylmethyl)acetamide
CID 110709223
3-amino-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)-1-methoxycyclobutane-1-carboxamide
CID 166305920
N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120617770
2-(cyclopropylmethylamino)-N-(3,4-dihydro-2H-chromen-4-ylmethyl)acetamide;hydrochloride
CID 119762189
1-(3,4-dihydro-2H-chromen-4-yl)-N-methylmethanamine;hydrochloride
CID 165145525
4-methoxy-N-(2-phenylethyl)piperidine-4-carboxamide;hydrochloride
CID 119670076
1-benzyl-3-(3,4-dihydro-2H-chromen-4-ylmethyl)urea
CID 110746942
1-cyclopropyl-N-(3,4-dihydro-2H-chromen-4-ylmethyl)methanamine
CID 63708653
4-amino-N-(3,4-dihydro-2H-chromen-4-ylmethyl)-3-methoxybutanamide
CID 120590979
N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methylbenzamide
CID 110709241
N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-fluorobenzamide
CID 110709244
N-[(2,2-dimethylcyclopropyl)methyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119785421

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride (CID 119762199) is N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride is COC1(C(=O)NCC2CCOc3ccccc32)CCNCC1.Cl.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
The InChIKey is ZJZYRFXSJMJYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3.ClH/c1-21-17(7-9-18-10-8-17)16(20)19-12-13-6-11-22-15-5-3-2-4-14(13)15;/h2-5,13,18H,6-12H2,1H3,(H,19,20);1H.
What are the key properties of N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride?
N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride has a molecular weight of 340.85 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119762199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).