1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine

C11H18N4 — CID 83866515

IUPAC1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine
SMILESCCc1nnc2n1C(C1(N)CC1)CCC2
InChIInChI=1S/C11H18N4/c1-2-9-13-14-10-5-3-4-8(15(9)10)11(12)6-7-11/h8H,2-7,12H2,1H3
InChIKeyIJPXXGCNMOSAKV-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.21
Rot. Bonds2

About 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine

1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine (PubChem CID 83866515) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine
PubChem CID83866515
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine
SMILESCCc1nnc2n1C(C1(N)CC1)CCC2
InChIInChI=1S/C11H18N4/c1-2-9-13-14-10-5-3-4-8(15(9)10)11(12)6-7-11/h8H,2-7,12H2,1H3
InChIKeyIJPXXGCNMOSAKV-UHFFFAOYSA-N
XLogP1.21
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine with MolForge

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Related Compounds

1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanamine
CID 112711497
3-propyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117150387
3-ethyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole-5-carboxylic acid
CID 82408556
3-(2-hydroxyethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-ol
CID 117149769
1-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)cyclobutan-1-amine
CID 79846172
3-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117150341
3-[(1-methylpiperidin-2-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117150125
1-(3-ethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)cyclopropan-1-amine
CID 83865201
5-methyl-3-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 117150571
(3-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)methanol
CID 117149677
3-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117150062
3-(2,2-dimethylpropyl)-5,6,7,8,9,10-hexahydro-[1,2,4]triazolo[4,3-a]azocine
CID 146137274

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine?
The IUPAC name of 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine (CID 83866515) is 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine is CCc1nnc2n1C(C1(N)CC1)CCC2.
What is the InChIKey of 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine?
The InChIKey is IJPXXGCNMOSAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-2-9-13-14-10-5-3-4-8(15(9)10)11(12)6-7-11/h8H,2-7,12H2,1H3.
What are the key properties of 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine?
1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine has a molecular weight of 206.29 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-5-yl)cyclopropan-1-amine is sourced from PubChem (CID 83866515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).