N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide

C17H24N2O3 — CID 120617770

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CCOc3ccccc32)CCNCC1
InChIInChI=1S/C17H24N2O3/c1-21-12-17(7-9-18-10-8-17)16(20)19-14-6-11-22-15-5-3-2-4-13(14)15/h2-5,14,18H,6-12H2,1H3,(H,19,20)
InChIKeyHVIPCPJGTRHFTJ-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.64
Rot. Bonds4

About N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide

N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120617770) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120617770
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CCOc3ccccc32)CCNCC1
InChIInChI=1S/C17H24N2O3/c1-21-12-17(7-9-18-10-8-17)16(20)19-14-6-11-22-15-5-3-2-4-13(14)15/h2-5,14,18H,6-12H2,1H3,(H,19,20)
InChIKeyHVIPCPJGTRHFTJ-UHFFFAOYSA-N
XLogP1.64
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dihydro-1H-inden-1-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120619174
N-(3,4-dihydro-2H-chromen-3-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623702
N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119762199
N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120619034
2-amino-N-(3,4-dihydro-2H-chromen-4-yl)-1-methylcyclopentane-1-carboxamide
CID 82765616
1-(3,4-dihydro-2H-chromen-4-yl)-2-[[1-(methoxymethyl)cyclobutyl]methyl]guanidine
CID 120762509
phenyl N-(3,4-dihydro-2H-chromen-4-yl)carbamate
CID 60655546
3-amino-N-(3,4-dihydro-2H-chromen-4-yl)propanamide;hydrochloride
CID 119268905
ethyl 2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoacetate
CID 62365066
N-(3,4-dihydro-2H-chromen-4-yl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119685157
4-(methoxymethyl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-4-carboxamide;hydrochloride
CID 120623245
N-(8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3-(methoxymethyl)oxetane-3-carboxamide
CID 166316760

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide (CID 120617770) is N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)NC2CCOc3ccccc32)CCNCC1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is HVIPCPJGTRHFTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-21-12-17(7-9-18-10-8-17)16(20)19-14-6-11-22-15-5-3-2-4-13(14)15/h2-5,14,18H,6-12H2,1H3,(H,19,20).
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide?
N-(3,4-dihydro-2H-chromen-4-yl)-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.64, 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-yl)-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120617770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).