1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide

C15H27N7O — CID 34768988

IUPAC1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide
SMILESCCNC(=O)C1CCN([C@H](C)c2nc(N)nc(N(C)C)n2)CC1
InChIInChI=1S/C15H27N7O/c1-5-17-13(23)11-6-8-22(9-7-11)10(2)12-18-14(16)20-15(19-12)21(3)4/h10-11H,5-9H2,1-4H3,(H,17,23)(H2,16,18,19,20)/t10-/m1/s1
InChIKeyPZRFFBNLUVPXCU-SNVBAGLBSA-N
MW321.43 g/mol
LogP0.43
Rot. Bonds5

About 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide

1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide (PubChem CID 34768988) has the molecular formula C15H27N7O and a molecular weight of 321.43 g/mol. Its IUPAC name is 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide
PubChem CID34768988
Molecular FormulaC15H27N7O
Molecular Weight321.43 g/mol
Exact Mass321.23
IUPAC Name1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide
SMILESCCNC(=O)C1CCN([C@H](C)c2nc(N)nc(N(C)C)n2)CC1
InChIInChI=1S/C15H27N7O/c1-5-17-13(23)11-6-8-22(9-7-11)10(2)12-18-14(16)20-15(19-12)21(3)4/h10-11H,5-9H2,1-4H3,(H,17,23)(H2,16,18,19,20)/t10-/m1/s1
InChIKeyPZRFFBNLUVPXCU-SNVBAGLBSA-N
XLogP0.43
TPSA100.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-(4,6-Dimethoxy-[1,3,5]triazin-2-yl)-piperidine-4-carboxylic acid sec-butylamide
CID 3222663
1-[[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]piperidine-4-carboxamide
CID 34682450
N-((4-(dimethylamino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl)methyl)-3,3,3-trifluoropropanamide
CID 122254620
1-[4-[[[4-(Dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]amino]methyl]piperidin-1-yl]-2,2,2-trifluoroethanone
CID 133419277
3-[[4-(Dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]amino]-1-(2,2,2-trifluoroethyl)piperidin-2-one
CID 133421694
[4-[1-[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperazin-1-yl]-cyclopentylmethanone
CID 42888235
2-Amino-N-(1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-3-methylbutyl)-4-methylpentanamide
CID 597304
2-Amino-N-(1-[((1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-3-methylbutyl)amino)carbonyl]-3-methylbutyl)-4-methylpentanamide
CID 624283
3-Methyl-1-piperazin-1-yl-2-(1,3,5-triazin-2-yl)pentan-1-one
CID 90033394
N-cyclopropyl-4-ethyl-5-[N'-[4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-yl]carbamimidoyl]iminohexanamide
CID 91003784
N-[2-[(4,6-dimethyl-1,3,5-triazin-2-yl)amino]ethyl]-2-methylbutanamide
CID 163515594
2-[Methyl-[4-(2-methylpropyl)-6-(4-propan-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]acetamide
CID 167424711

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide?
The IUPAC name of 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide (CID 34768988) is 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide?
The canonical SMILES for 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide is CCNC(=O)C1CCN([C@H](C)c2nc(N)nc(N(C)C)n2)CC1.
What is the InChIKey of 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide?
The InChIKey is PZRFFBNLUVPXCU-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H27N7O/c1-5-17-13(23)11-6-8-22(9-7-11)10(2)12-18-14(16)20-15(19-12)21(3)4/h10-11H,5-9H2,1-4H3,(H,17,23)(H2,16,18,19,20)/t10-/m1/s1.
What are the key properties of 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide?
1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide has a molecular weight of 321.43 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-N-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 34768988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).