2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide

C18H28N4O2 — CID 120800744

IUPAC2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide
SMILESCc1cccc(N2CCC(NC(=O)C(N)C3CCOCC3)CC2)n1
InChIInChI=1S/C18H28N4O2/c1-13-3-2-4-16(20-13)22-9-5-15(6-10-22)21-18(23)17(19)14-7-11-24-12-8-14/h2-4,14-15,17H,5-12,19H2,1H3,(H,21,23)
InChIKeyTYPAUTOTYHQJKG-UHFFFAOYSA-N
MW332.45 g/mol
LogP1.23
Rot. Bonds4

About 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide

2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide (PubChem CID 120800744) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide
PubChem CID120800744
Molecular FormulaC18H28N4O2
Molecular Weight332.45 g/mol
Exact Mass332.22
IUPAC Name2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide
SMILESCc1cccc(N2CCC(NC(=O)C(N)C3CCOCC3)CC2)n1
InChIInChI=1S/C18H28N4O2/c1-13-3-2-4-16(20-13)22-9-5-15(6-10-22)21-18(23)17(19)14-7-11-24-12-8-14/h2-4,14-15,17H,5-12,19H2,1H3,(H,21,23)
InChIKeyTYPAUTOTYHQJKG-UHFFFAOYSA-N
XLogP1.23
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120798994
N-[2-[[ethylamino-[[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]methylidene]amino]ethyl]-2-methylpropanamide
CID 111995395
1-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 133313226
1-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-3-[(1R,3S)-3-methylsulfanylcyclopentyl]urea
CID 96518828
ethane;4-(6-methyl-2-pyridinyl)morpholine
CID 143966353
azane;4-(6-methyl-2-pyridinyl)morpholine
CID 175085700
2-amino-2-(oxan-4-yl)-N-[1-(2-phenylbutanoyl)piperidin-4-yl]acetamide;hydrochloride
CID 120791093
1-(3-hydroxy-4-methylpentyl)-3-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]urea
CID 111506440
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-3-yl)acetamide;dihydrochloride
CID 120800731
(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide
CID 99824847
2-amino-2-(oxan-4-yl)-N-[1-(3-phenylpropanoyl)piperidin-4-yl]acetamide
CID 120788504
2-amino-N-[1-(2-fluorobenzoyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120786287

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide (CID 120800744) is 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide is Cc1cccc(N2CCC(NC(=O)C(N)C3CCOCC3)CC2)n1.
What is the InChIKey of 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide?
The InChIKey is TYPAUTOTYHQJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O2/c1-13-3-2-4-16(20-13)22-9-5-15(6-10-22)21-18(23)17(19)14-7-11-24-12-8-14/h2-4,14-15,17H,5-12,19H2,1H3,(H,21,23).
What are the key properties of 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide?
2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide has a molecular weight of 332.45 g/mol, XLogP of 1.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120800744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).