N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide

C10H14N4O3 — CID 122252737

IUPACN-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide
SMILESCOc1nc(CNC(=O)C2CC2)nc(OC)n1
InChIInChI=1S/C10H14N4O3/c1-16-9-12-7(13-10(14-9)17-2)5-11-8(15)6-3-4-6/h6H,3-5H2,1-2H3,(H,11,15)
InChIKeyBKEFUQADKOCGQL-UHFFFAOYSA-N
MW238.25 g/mol
LogP-0.09
Rot. Bonds5

About N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide

N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide (PubChem CID 122252737) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide
PubChem CID122252737
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC NameN-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide
SMILESCOc1nc(CNC(=O)C2CC2)nc(OC)n1
InChIInChI=1S/C10H14N4O3/c1-16-9-12-7(13-10(14-9)17-2)5-11-8(15)6-3-4-6/h6H,3-5H2,1-2H3,(H,11,15)
InChIKeyBKEFUQADKOCGQL-UHFFFAOYSA-N
XLogP-0.09
TPSA86.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide
CID 122252863
N-[(4-methoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)methyl]cyclobutanecarboxamide
CID 122253254
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]oxane-4-carboxamide
CID 122253832
1-cyclopropyl-2-(4,6-dimethoxy-1,3,5-triazin-2-yl)ethanone
CID 63355125
3-amino-N-[(4,6-dimethylpyrimidin-2-yl)methyl]cyclopentane-1-carboxamide
CID 156609240
N-[(4-methoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)methyl]acetamide
CID 122253100
cis-(1S,3R)-3-amino-N-[(4,6-dimethylpyrimidin-2-yl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 154910286
N-[(1-methyl-1,2,4-triazol-3-yl)methyl]cyclopropanecarboxamide
CID 103883571
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-4-ethylbenzamide
CID 122252725
N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide
CID 71807461
N-[(2-methoxy-4-pyridinyl)methyl]cyclopropanecarboxamide
CID 60715595
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-3-(4-methoxyphenyl)propanamide
CID 121137428

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide (CID 122252737) is N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide is COc1nc(CNC(=O)C2CC2)nc(OC)n1.
What is the InChIKey of N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide?
The InChIKey is BKEFUQADKOCGQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c1-16-9-12-7(13-10(14-9)17-2)5-11-8(15)6-3-4-6/h6H,3-5H2,1-2H3,(H,11,15).
What are the key properties of N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide?
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide has a molecular weight of 238.25 g/mol, XLogP of -0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 122252737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).