N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine

C11H18N4 — CID 66193785

IUPACN-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine
SMILESc1c(CNC2CC2)nnn1C1CCCC1
InChIInChI=1S/C11H18N4/c1-2-4-11(3-1)15-8-10(13-14-15)7-12-9-5-6-9/h8-9,11-12H,1-7H2
InChIKeyZBVBCYDYLVRRDD-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.65
Rot. Bonds4

About N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine

N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine (PubChem CID 66193785) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine
PubChem CID66193785
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine
SMILESc1c(CNC2CC2)nnn1C1CCCC1
InChIInChI=1S/C11H18N4/c1-2-4-11(3-1)15-8-10(13-14-15)7-12-9-5-6-9/h8-9,11-12H,1-7H2
InChIKeyZBVBCYDYLVRRDD-UHFFFAOYSA-N
XLogP1.65
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(oxan-3-yl)triazol-4-yl]methyl]cyclopropanamine
CID 107137979
4-(bromomethyl)-1-cycloheptyltriazole
CID 82930345
(1-cyclobutyltriazol-4-yl)methanamine
CID 84649674
2-chloro-N-[(1-cyclopentyltriazol-4-yl)methyl]acetamide
CID 166430643
(1-cyclobutyltriazol-4-yl)methanamine;dihydrochloride
CID 122156702
4-chloro-N-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-amine
CID 107054010
N-[2-[4-[(cyclopropylamino)methyl]triazol-1-yl]ethyl]-N-methylcyclopentanamine
CID 62418703
N-[[1-(1-propan-2-ylpiperidin-4-yl)triazol-4-yl]methyl]propan-2-amine
CID 171743056
4-chloro-N-[(1-cyclohexylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 65023954
(6R,7R)-7-[(1-cyclobutyltriazol-4-yl)methylamino]-2-methyl-3-propan-2-yl-2-azaspiro[3.4]octan-6-ol
CID 154767507
N-[[1-(3-methoxycyclohexyl)triazol-4-yl]methyl]ethanamine
CID 66193890
N-[(1-benzyltriazol-4-yl)methyl]cyclopropanamine
CID 66193410

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine (CID 66193785) is N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine is c1c(CNC2CC2)nnn1C1CCCC1.
What is the InChIKey of N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine?
The InChIKey is ZBVBCYDYLVRRDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-2-4-11(3-1)15-8-10(13-14-15)7-12-9-5-6-9/h8-9,11-12H,1-7H2.
What are the key properties of N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine?
N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine has a molecular weight of 206.29 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyltriazol-4-yl)methyl]cyclopropanamine is sourced from PubChem (CID 66193785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).