1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide

C11H18N6O — CID 70672915

IUPAC1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide
SMILESCc1nc(N(C)C)nc(N2CCCC2C(N)=O)n1
InChIInChI=1S/C11H18N6O/c1-7-13-10(16(2)3)15-11(14-7)17-6-4-5-8(17)9(12)18/h8H,4-6H2,1-3H3,(H2,12,18)
InChIKeyCTWFCMONSLREOE-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.30
Rot. Bonds3

About 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide

1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide (PubChem CID 70672915) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide
PubChem CID70672915
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC Name1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide
SMILESCc1nc(N(C)C)nc(N2CCCC2C(N)=O)n1
InChIInChI=1S/C11H18N6O/c1-7-13-10(16(2)3)15-11(14-7)17-6-4-5-8(17)9(12)18/h8H,4-6H2,1-3H3,(H2,12,18)
InChIKeyCTWFCMONSLREOE-UHFFFAOYSA-N
XLogP-0.30
TPSA88.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-1-(4-amino-6-ethyl-1,3,5-triazin-2-yl)-4,4-difluoro-N-methylpyrrolidine-2-carboxamide
CID 167860504
3-[(4,6-Diamino-1,3,5-triazin-2-yl)methyl]-5-propylimidazolidine-2,4-dione
CID 22108669
(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-N-methylpyrrolidine-2-carboxamide
CID 59474157
(2S)-1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide
CID 59474177
(2S)-1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidine-2-carboxamide
CID 59474208
1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-N-methylpyrrolidine-2-carboxamide
CID 70672911
1-(4-Methoxy-6-methyl-1,3,5-triazin-2-yl)pyrrolidine-2-carboxamide
CID 70672913
1-(4,6-Dimethyl-1,3,5-triazin-2-yl)pyrrolidine-2-carboxamide
CID 70907636
(2S)-1-(4,6-dimethyl-1,3,5-triazin-2-yl)pyrrolidine-2-carboxamide
CID 70907638
1-[4-(Dimethylamino)-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide
CID 89796576
(2S)-1-[4-(dimethylamino)-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide
CID 89796577
1-(4-Chloro-6-methyl-1,3,5-triazin-2-yl)pyrrolidine-2-carboxamide
CID 89796599

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide (CID 70672915) is 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide is Cc1nc(N(C)C)nc(N2CCCC2C(N)=O)n1.
What is the InChIKey of 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide?
The InChIKey is CTWFCMONSLREOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c1-7-13-10(16(2)3)15-11(14-7)17-6-4-5-8(17)9(12)18/h8H,4-6H2,1-3H3,(H2,12,18).
What are the key properties of 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide?
1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide has a molecular weight of 250.31 g/mol, XLogP of -0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)-6-methyl-1,3,5-triazin-2-yl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 70672915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).