N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide

C17H26N4O4 — CID 47089985

IUPACN-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide
SMILESCCNC(=O)NC(=O)C(C)N1CCC(NC(=O)c2occc2C)CC1
InChIInChI=1S/C17H26N4O4/c1-4-18-17(24)20-15(22)12(3)21-8-5-13(6-9-21)19-16(23)14-11(2)7-10-25-14/h7,10,12-13H,4-6,8-9H2,1-3H3,(H,19,23)(H2,18,20,22,24)
InChIKeyHVSJQEWXQJMSIA-UHFFFAOYSA-N
MW350.42 g/mol
LogP1.02
Rot. Bonds5

About N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide

N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide (PubChem CID 47089985) has the molecular formula C17H26N4O4 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide
PubChem CID47089985
Molecular FormulaC17H26N4O4
Molecular Weight350.42 g/mol
Exact Mass350.20
IUPAC NameN-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide
SMILESCCNC(=O)NC(=O)C(C)N1CCC(NC(=O)c2occc2C)CC1
InChIInChI=1S/C17H26N4O4/c1-4-18-17(24)20-15(22)12(3)21-8-5-13(6-9-21)19-16(23)14-11(2)7-10-25-14/h7,10,12-13H,4-6,8-9H2,1-3H3,(H,19,23)(H2,18,20,22,24)
InChIKeyHVSJQEWXQJMSIA-UHFFFAOYSA-N
XLogP1.02
TPSA103.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide with MolForge

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Related Compounds

N-cyclopropyl-3-methylfuran-2-carboxamide
CID 60675996
N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide
CID 46614180
3-methyl-N-[1-(1-phenylethyl)pyrrolidin-3-yl]furan-2-carboxamide
CID 51091908
N-[1-[1-(cyclopropylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]benzamide
CID 51289715
N-[1-[1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-2-methylbenzamide
CID 55851155
(2R)-2-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 95269319
methyl 1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidine-4-carboxylate
CID 60638894
N-[1-[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-5-methylthiophene-2-carboxamide
CID 94380039
N-(3-chloro-4-methylphenyl)-4-[(2R)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperazine-1-carboxamide
CID 97099947
2-(3-aminopyrrolidin-1-yl)-N-(ethylcarbamoyl)propanamide;hydrochloride
CID 119917700
N-(ethylcarbamoyl)-2-piperazin-1-ylpropanamide
CID 43089574
N-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-3-methylfuran-2-carboxamide
CID 47090079

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide?
The IUPAC name of N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide (CID 47089985) is N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide.
What is the SMILES notation for N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide?
The canonical SMILES for N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide is CCNC(=O)NC(=O)C(C)N1CCC(NC(=O)c2occc2C)CC1.
What is the InChIKey of N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide?
The InChIKey is HVSJQEWXQJMSIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O4/c1-4-18-17(24)20-15(22)12(3)21-8-5-13(6-9-21)19-16(23)14-11(2)7-10-25-14/h7,10,12-13H,4-6,8-9H2,1-3H3,(H,19,23)(H2,18,20,22,24).
What are the key properties of N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide?
N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]-3-methylfuran-2-carboxamide is sourced from PubChem (CID 47089985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).