2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide

C16H24N4O — CID 82034085

IUPAC2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide
SMILESCC(Nc1ccc(NC(=O)CN)nc1)C1CC2CCC1C2
InChIInChI=1S/C16H24N4O/c1-10(14-7-11-2-3-12(14)6-11)19-13-4-5-15(18-9-13)20-16(21)8-17/h4-5,9-12,14,19H,2-3,6-8,17H2,1H3,(H,18,20,21)
InChIKeyUNFQZMSJQJVGTJ-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.22
Rot. Bonds5

About 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide

2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide (PubChem CID 82034085) has the molecular formula C16H24N4O and a molecular weight of 288.40 g/mol. Its IUPAC name is 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide
PubChem CID82034085
Molecular FormulaC16H24N4O
Molecular Weight288.40 g/mol
Exact Mass288.20
IUPAC Name2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide
SMILESCC(Nc1ccc(NC(=O)CN)nc1)C1CC2CCC1C2
InChIInChI=1S/C16H24N4O/c1-10(14-7-11-2-3-12(14)6-11)19-13-4-5-15(18-9-13)20-16(21)8-17/h4-5,9-12,14,19H,2-3,6-8,17H2,1H3,(H,18,20,21)
InChIKeyUNFQZMSJQJVGTJ-UHFFFAOYSA-N
XLogP2.22
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 79764561
2-amino-N-[5-(butan-2-ylamino)-2-pyridinyl]acetamide
CID 82034084
4-N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]benzene-1,4-diamine
CID 43115419
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-chloropyridin-2-amine
CID 43098628
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104639772
2-amino-N-[2-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-oxoethyl]acetamide
CID 60848983
4-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N-methylpyridine-2-carboxamide
CID 43517740
2-amino-N-(5-propan-2-yl-2-pyridinyl)acetamide
CID 167366169
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-fluoropyrimidin-2-amine
CID 112703061
N'-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-N-(4-ethoxyphenyl)oxamide
CID 108514526
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-4-(carbamoylamino)benzamide
CID 78789513
2-N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-6-ethoxypyridine-2,5-diamine
CID 43261074

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide?
The IUPAC name of 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide (CID 82034085) is 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide.
What is the SMILES notation for 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide?
The canonical SMILES for 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide is CC(Nc1ccc(NC(=O)CN)nc1)C1CC2CCC1C2.
What is the InChIKey of 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide?
The InChIKey is UNFQZMSJQJVGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-10(14-7-11-2-3-12(14)6-11)19-13-4-5-15(18-9-13)20-16(21)8-17/h4-5,9-12,14,19H,2-3,6-8,17H2,1H3,(H,18,20,21).
What are the key properties of 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide?
2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide has a molecular weight of 288.40 g/mol, XLogP of 2.22, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide is sourced from PubChem (CID 82034085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).