N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide

C13H21N5O2 — CID 122252863

IUPACN-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide
SMILESCOc1nc(CNC(=O)C2CCCC2)nc(N(C)C)n1
InChIInChI=1S/C13H21N5O2/c1-18(2)12-15-10(16-13(17-12)20-3)8-14-11(19)9-6-4-5-7-9/h9H,4-8H2,1-3H3,(H,14,19)
InChIKeyHMAAZMYUUOQPKX-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.75
Rot. Bonds5

About N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide

N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide (PubChem CID 122252863) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide
PubChem CID122252863
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC NameN-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide
SMILESCOc1nc(CNC(=O)C2CCCC2)nc(N(C)C)n1
InChIInChI=1S/C13H21N5O2/c1-18(2)12-15-10(16-13(17-12)20-3)8-14-11(19)9-6-4-5-7-9/h9H,4-8H2,1-3H3,(H,14,19)
InChIKeyHMAAZMYUUOQPKX-UHFFFAOYSA-N
XLogP0.75
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]cyclopropanecarboxamide
CID 122252737
N-[(4-methoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)methyl]cyclobutanecarboxamide
CID 122253254
N-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]methyl]-6-oxopiperidine-3-carboxamide
CID 122254077
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]oxane-4-carboxamide
CID 122253832
N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 122253028
N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]-3-methoxy-1-methylpyrazole-4-carboxamide
CID 122252982
N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 122252963
2-(4-chlorophenoxy)-N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]acetamide
CID 122252894
[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methylcyanamide
CID 22299268
5-chloro-N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]-2-methoxybenzamide
CID 122252893
1-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 122253099
2-bromo-N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]-5-methoxybenzamide
CID 122253015

Frequently Asked Questions

What is the IUPAC name of N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide?
The IUPAC name of N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide (CID 122252863) is N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide?
The canonical SMILES for N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide is COc1nc(CNC(=O)C2CCCC2)nc(N(C)C)n1.
What is the InChIKey of N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide?
The InChIKey is HMAAZMYUUOQPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-18(2)12-15-10(16-13(17-12)20-3)8-14-11(19)9-6-4-5-7-9/h9H,4-8H2,1-3H3,(H,14,19).
What are the key properties of N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide?
N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide has a molecular weight of 279.34 g/mol, XLogP of 0.75, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]methyl]cyclopentanecarboxamide is sourced from PubChem (CID 122252863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).