[4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone

C11H19N5O — CID 110471518

IUPAC[4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone
SMILESCN(C)C1CCN(C(=O)c2cn(C)nn2)CC1
InChIInChI=1S/C11H19N5O/c1-14(2)9-4-6-16(7-5-9)11(17)10-8-15(3)13-12-10/h8-9H,4-7H2,1-3H3
InChIKeyMUZNYRZXSMQDPF-UHFFFAOYSA-N
MW237.31 g/mol
LogP-0.02
Rot. Bonds2

About [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone

[4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone (PubChem CID 110471518) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone.

Molecular Properties

Compound Name[4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone
PubChem CID110471518
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name[4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone
SMILESCN(C)C1CCN(C(=O)c2cn(C)nn2)CC1
InChIInChI=1S/C11H19N5O/c1-14(2)9-4-6-16(7-5-9)11(17)10-8-15(3)13-12-10/h8-9H,4-7H2,1-3H3
InChIKeyMUZNYRZXSMQDPF-UHFFFAOYSA-N
XLogP-0.02
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-methyltriazole-4-carbonyl)piperidine-4-carboxylic acid
CID 110461894
(3-chloropyrrolidin-1-yl)-(1-methyltriazol-4-yl)methanone
CID 130521214
[4-(chloromethyl)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone
CID 164663089
[(3R,4S)-3-fluoro-4-hydroxypiperidin-1-yl]-(1-methyltriazol-4-yl)methanone
CID 129270615
(3,5-dimethylpiperidin-1-yl)-(1-methyltriazol-4-yl)methanone
CID 110436926
[3-(bromomethyl)pyrrolidin-1-yl]-(1-methyltriazol-4-yl)methanone
CID 130521226
(3-bromo-4-methylpiperidin-1-yl)-(1-methyltriazol-4-yl)methanone
CID 164663138
(3-aminopiperidin-1-yl)-(1-methyltriazol-4-yl)methanone
CID 121200479
(1-methyltriazol-4-yl)-(7-phenyl-1,4-thiazepan-4-yl)methanone
CID 90629466
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(1-methyltriazol-4-yl)methanone
CID 110691585
(1-methyltriazol-4-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
CID 110471567
[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-[1-(3-phenylpropyl)triazol-4-yl]methanone
CID 25374522

Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone?
The IUPAC name of [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone (CID 110471518) is [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone.
What is the SMILES notation for [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone?
The canonical SMILES for [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone is CN(C)C1CCN(C(=O)c2cn(C)nn2)CC1.
What is the InChIKey of [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone?
The InChIKey is MUZNYRZXSMQDPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-14(2)9-4-6-16(7-5-9)11(17)10-8-15(3)13-12-10/h8-9H,4-7H2,1-3H3.
What are the key properties of [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone?
[4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone has a molecular weight of 237.31 g/mol, XLogP of -0.02, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)piperidin-1-yl]-(1-methyltriazol-4-yl)methanone is sourced from PubChem (CID 110471518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).