N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide

C13H17N5O2 — CID 59874346

IUPACN-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
SMILESCCC(Nc1nc(C)nc(NC(C)=O)n1)c1ccco1
InChIInChI=1S/C13H17N5O2/c1-4-10(11-6-5-7-20-11)17-13-15-8(2)14-12(18-13)16-9(3)19/h5-7,10H,4H2,1-3H3,(H2,14,15,16,17,18,19)
InChIKeyGSRHIGLWTNMSBU-UHFFFAOYSA-N
MW275.31 g/mol
LogP2.29
Rot. Bonds5

About N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide

N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide (PubChem CID 59874346) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
PubChem CID59874346
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC NameN-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide
SMILESCCC(Nc1nc(C)nc(NC(C)=O)n1)c1ccco1
InChIInChI=1S/C13H17N5O2/c1-4-10(11-6-5-7-20-11)17-13-15-8(2)14-12(18-13)16-9(3)19/h5-7,10H,4H2,1-3H3,(H2,14,15,16,17,18,19)
InChIKeyGSRHIGLWTNMSBU-UHFFFAOYSA-N
XLogP2.29
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-allyl-6-chloro-N'-(2-furylmethyl)-1,3,5-triazine-2,4-diamine
CID 2053611
N-Allyl-6-ethoxy-N'-furan-2-ylmethyl-[1,3,5]triazine-2,4-diamine
CID 649892
6-Ethoxy-N-furan-2-ylmethyl-N'-hexyl-[1,3,5]triazine-2,4-diamine
CID 3128957
N-cyclohexyl-N-{4-[(2-furylmethyl)amino]-6-methoxy-1,3,5-triazin-2-yl}amine
CID 821248
6-Chloro-N-furan-2-ylmethyl-N'-octyl-[1,3,5]triazine-2,4-diamine
CID 3121128
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide
CID 51080852
N-(furan-2-ylmethyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
CID 53338094
2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-(furan-2-ylmethyl)piperidine-1-carboxamide
CID 53338101
2-(furan-2-yl)-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]pyrrolidine-1-sulfonamide
CID 71873007
2-(furan-2-yl)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-1-sulfonamide
CID 71873037
6-chloro-N-(furan-2-ylmethyl)-N'-hexyl-1,3,5-triazine-2,4-diamine
CID 3124820
N~1~,N~1~-diethyl-1-(2-furyl)-N~2~-1,3,5-triazin-2-ylethane-1,2-diamine
CID 91790667

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
The IUPAC name of N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide (CID 59874346) is N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide.
What is the SMILES notation for N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
The canonical SMILES for N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide is CCC(Nc1nc(C)nc(NC(C)=O)n1)c1ccco1.
What is the InChIKey of N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
The InChIKey is GSRHIGLWTNMSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-4-10(11-6-5-7-20-11)17-13-15-8(2)14-12(18-13)16-9(3)19/h5-7,10H,4H2,1-3H3,(H2,14,15,16,17,18,19).
What are the key properties of N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide?
N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide has a molecular weight of 275.31 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(furan-2-yl)propylamino]-6-methyl-1,3,5-triazin-2-yl]acetamide is sourced from PubChem (CID 59874346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).