2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide

C14H22N4O — CID 80629884

IUPAC2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide
SMILESCc1cc(CN)cnc1N(CC(N)=O)C1CCCC1
InChIInChI=1S/C14H22N4O/c1-10-6-11(7-15)8-17-14(10)18(9-13(16)19)12-4-2-3-5-12/h6,8,12H,2-5,7,9,15H2,1H3,(H2,16,19)
InChIKeyOWGMVQVJUBWXRS-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.08
Rot. Bonds5

About 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide

2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide (PubChem CID 80629884) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide.

Molecular Properties

Compound Name2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide
PubChem CID80629884
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide
SMILESCc1cc(CN)cnc1N(CC(N)=O)C1CCCC1
InChIInChI=1S/C14H22N4O/c1-10-6-11(7-15)8-17-14(10)18(9-13(16)19)12-4-2-3-5-12/h6,8,12H,2-5,7,9,15H2,1H3,(H2,16,19)
InChIKeyOWGMVQVJUBWXRS-UHFFFAOYSA-N
XLogP1.08
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide?
The IUPAC name of 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide (CID 80629884) is 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide.
What is the SMILES notation for 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide?
The canonical SMILES for 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide is Cc1cc(CN)cnc1N(CC(N)=O)C1CCCC1.
What is the InChIKey of 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide?
The InChIKey is OWGMVQVJUBWXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-6-11(7-15)8-17-14(10)18(9-13(16)19)12-4-2-3-5-12/h6,8,12H,2-5,7,9,15H2,1H3,(H2,16,19).
What are the key properties of 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide?
2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide has a molecular weight of 262.36 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide is sourced from PubChem (CID 80629884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).