N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide

C10H17N5O — CID 81478484

IUPACN-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide
SMILESNCC1(NC(=O)Cn2ccnn2)CCCC1
InChIInChI=1S/C10H17N5O/c11-8-10(3-1-2-4-10)13-9(16)7-15-6-5-12-14-15/h5-6H,1-4,7-8,11H2,(H,13,16)
InChIKeyOFKGJGWACPBSNL-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.33
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide

N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide (PubChem CID 81478484) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide
PubChem CID81478484
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide
SMILESNCC1(NC(=O)Cn2ccnn2)CCCC1
InChIInChI=1S/C10H17N5O/c11-8-10(3-1-2-4-10)13-9(16)7-15-6-5-12-14-15/h5-6H,1-4,7-8,11H2,(H,13,16)
InChIKeyOFKGJGWACPBSNL-UHFFFAOYSA-N
XLogP-0.33
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide (CID 81478484) is N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide is NCC1(NC(=O)Cn2ccnn2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide?
The InChIKey is OFKGJGWACPBSNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c11-8-10(3-1-2-4-10)13-9(16)7-15-6-5-12-14-15/h5-6H,1-4,7-8,11H2,(H,13,16).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide?
N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide has a molecular weight of 223.28 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-(triazol-1-yl)acetamide is sourced from PubChem (CID 81478484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).