N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine

C16H29N5 — CID 107049969

IUPACN-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
SMILESCNC(Cc1cn(C)nn1)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C16H29N5/c1-17-15(12-14-13-20(2)19-18-14)16(8-4-5-9-16)21-10-6-3-7-11-21/h13,15,17H,3-12H2,1-2H3
InChIKeyFCSMETXBCZXWCS-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.74
Rot. Bonds5

About N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine

N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine (PubChem CID 107049969) has the molecular formula C16H29N5 and a molecular weight of 291.44 g/mol. Its IUPAC name is N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
PubChem CID107049969
Molecular FormulaC16H29N5
Molecular Weight291.44 g/mol
Exact Mass291.24
IUPAC NameN-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
SMILESCNC(Cc1cn(C)nn1)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C16H29N5/c1-17-15(12-14-13-20(2)19-18-14)16(8-4-5-9-16)21-10-6-3-7-11-21/h13,15,17H,3-12H2,1-2H3
InChIKeyFCSMETXBCZXWCS-UHFFFAOYSA-N
XLogP1.74
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(2-methyloxan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107050468
2-(1-methyltriazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
CID 107049977
N-methyl-2-(1-methylimidazol-2-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
CID 79751944
N-methyl-2-(1-methylpyrazol-3-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
CID 82869589
N-methyl-2-(1-methyltriazol-4-yl)-1-(1-phenylcyclopropyl)ethanamine
CID 107049115
N-methyl-2-(1-methylimidazol-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
CID 79761283
1-[1-hydroxy-2-(1-methyltriazol-4-yl)ethyl]cycloheptan-1-ol
CID 107048234
[2-(1-methylpyrazol-3-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethyl]hydrazine
CID 105242808
1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107063793
[2-(1-methylpyrazol-4-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)ethyl]hydrazine
CID 105242848
2-methoxy-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
CID 79568733
2-(3-bromophenyl)-N-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
CID 79060381

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine?
The IUPAC name of N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine (CID 107049969) is N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine.
What is the SMILES notation for N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine?
The canonical SMILES for N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine is CNC(Cc1cn(C)nn1)C1(N2CCCCC2)CCCC1.
What is the InChIKey of N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine?
The InChIKey is FCSMETXBCZXWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5/c1-17-15(12-14-13-20(2)19-18-14)16(8-4-5-9-16)21-10-6-3-7-11-21/h13,15,17H,3-12H2,1-2H3.
What are the key properties of N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine?
N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine has a molecular weight of 291.44 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine is sourced from PubChem (CID 107049969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).