N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide

C14H21N5O3 — CID 3222664

IUPACN-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide
SMILESCOc1nc(OC)nc(N2CCC(C(=O)NC3CC3)CC2)n1
InChIInChI=1S/C14H21N5O3/c1-21-13-16-12(17-14(18-13)22-2)19-7-5-9(6-8-19)11(20)15-10-3-4-10/h9-10H,3-8H2,1-2H3,(H,15,20)
InChIKeyYOAYAADXQJNXMM-UHFFFAOYSA-N
MW307.35 g/mol
LogP0.38
Rot. Bonds5

About N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide

N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide (PubChem CID 3222664) has the molecular formula C14H21N5O3 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide
PubChem CID3222664
Molecular FormulaC14H21N5O3
Molecular Weight307.35 g/mol
Exact Mass307.16
IUPAC NameN-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide
SMILESCOc1nc(OC)nc(N2CCC(C(=O)NC3CC3)CC2)n1
InChIInChI=1S/C14H21N5O3/c1-21-13-16-12(17-14(18-13)22-2)19-7-5-9(6-8-19)11(20)15-10-3-4-10/h9-10H,3-8H2,1-2H3,(H,15,20)
InChIKeyYOAYAADXQJNXMM-UHFFFAOYSA-N
XLogP0.38
TPSA89.47 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide (CID 3222664) is N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide is COc1nc(OC)nc(N2CCC(C(=O)NC3CC3)CC2)n1.
What is the InChIKey of N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
The InChIKey is YOAYAADXQJNXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O3/c1-21-13-16-12(17-14(18-13)22-2)19-7-5-9(6-8-19)11(20)15-10-3-4-10/h9-10H,3-8H2,1-2H3,(H,15,20).
What are the key properties of N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide?
N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 3222664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).