N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide

C16H25N3O2 — CID 91835522

IUPACN-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
SMILESCN(CC(=O)NCCC1(O)CCCC1)Cc1ccncc1
InChIInChI=1S/C16H25N3O2/c1-19(12-14-4-9-17-10-5-14)13-15(20)18-11-8-16(21)6-2-3-7-16/h4-5,9-10,21H,2-3,6-8,11-13H2,1H3,(H,18,20)
InChIKeyFTYTVRUVTKZVSM-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.32
Rot. Bonds7

About N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide

N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide (PubChem CID 91835522) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
PubChem CID91835522
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
SMILESCN(CC(=O)NCCC1(O)CCCC1)Cc1ccncc1
InChIInChI=1S/C16H25N3O2/c1-19(12-14-4-9-17-10-5-14)13-15(20)18-11-8-16(21)6-2-3-7-16/h4-5,9-10,21H,2-3,6-8,11-13H2,1H3,(H,18,20)
InChIKeyFTYTVRUVTKZVSM-UHFFFAOYSA-N
XLogP1.32
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[benzyl(methyl)amino]-N-[(1-hydroxycycloheptyl)methyl]acetamide
CID 111428717
2-[methyl(pyridin-4-ylmethyl)amino]-N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide
CID 91839967
N-[2-(5-methylfuran-2-yl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
CID 90651083
N-[(1-cyclohexylpyrrolidin-3-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
CID 91772553
2-[benzyl(methyl)amino]-N-(2-phenylethyl)acetamide
CID 54808729
2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide
CID 131914362
N-[1-(cyclohexen-1-yl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
CID 91833217
N-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
CID 91776968
3-[methyl(pyridin-4-ylmethyl)amino]propanehydrazide
CID 63573503
2-[(5-chloro-2-pyridinyl)-methylamino]-N-[(1-hydroxycyclohexyl)methyl]acetamide
CID 64868265
4-[[methyl(pyridin-4-ylmethyl)amino]methyl]oxan-4-ol
CID 113269052
4-[[methyl(pyridin-4-ylmethyl)amino]methyl]piperidin-4-ol
CID 62221509

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
The IUPAC name of N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide (CID 91835522) is N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide.
What is the SMILES notation for N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
The canonical SMILES for N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide is CN(CC(=O)NCCC1(O)CCCC1)Cc1ccncc1.
What is the InChIKey of N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
The InChIKey is FTYTVRUVTKZVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-19(12-14-4-9-17-10-5-14)13-15(20)18-11-8-16(21)6-2-3-7-16/h4-5,9-10,21H,2-3,6-8,11-13H2,1H3,(H,18,20).
What are the key properties of N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide?
N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.32, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide is sourced from PubChem (CID 91835522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).