N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide

C17H24N2O3 — CID 111430830

IUPACN-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
SMILESO=C(CC1(O)CCCC1)NCc1ccc(OCC2CC2)nc1
InChIInChI=1S/C17H24N2O3/c20-15(9-17(21)7-1-2-8-17)18-10-14-5-6-16(19-11-14)22-12-13-3-4-13/h5-6,11,13,21H,1-4,7-10,12H2,(H,18,20)
InChIKeyJIIMTTPFJSINAD-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.18
Rot. Bonds7

About N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide

N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide (PubChem CID 111430830) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide.

Molecular Properties

Compound NameN-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
PubChem CID111430830
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
SMILESO=C(CC1(O)CCCC1)NCc1ccc(OCC2CC2)nc1
InChIInChI=1S/C17H24N2O3/c20-15(9-17(21)7-1-2-8-17)18-10-14-5-6-16(19-11-14)22-12-13-3-4-13/h5-6,11,13,21H,1-4,7-10,12H2,(H,18,20)
InChIKeyJIIMTTPFJSINAD-UHFFFAOYSA-N
XLogP2.18
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide?
The IUPAC name of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide (CID 111430830) is N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide.
What is the SMILES notation for N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide?
The canonical SMILES for N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide is O=C(CC1(O)CCCC1)NCc1ccc(OCC2CC2)nc1.
What is the InChIKey of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide?
The InChIKey is JIIMTTPFJSINAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-15(9-17(21)7-1-2-8-17)18-10-14-5-6-16(19-11-14)22-12-13-3-4-13/h5-6,11,13,21H,1-4,7-10,12H2,(H,18,20).
What are the key properties of N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide?
N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide has a molecular weight of 304.39 g/mol, XLogP of 2.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-2-(1-hydroxycyclopentyl)acetamide is sourced from PubChem (CID 111430830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).