1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide

C14H25NO3 — CID 124732651

IUPAC1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide
SMILESCCOC1(C(=O)NC[C@@H]2CCC[C@H]2O)CCCC1
InChIInChI=1S/C14H25NO3/c1-2-18-14(8-3-4-9-14)13(17)15-10-11-6-5-7-12(11)16/h11-12,16H,2-10H2,1H3,(H,15,17)/t11-,12+/m0/s1
InChIKeyJTZTVZLCYROJJM-NWDGAFQWSA-N
MW255.36 g/mol
LogP1.61
Rot. Bonds5

About 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide

1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide (PubChem CID 124732651) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide
PubChem CID124732651
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Name1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide
SMILESCCOC1(C(=O)NC[C@@H]2CCC[C@H]2O)CCCC1
InChIInChI=1S/C14H25NO3/c1-2-18-14(8-3-4-9-14)13(17)15-10-11-6-5-7-12(11)16/h11-12,16H,2-10H2,1H3,(H,15,17)/t11-,12+/m0/s1
InChIKeyJTZTVZLCYROJJM-NWDGAFQWSA-N
XLogP1.61
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide (CID 124732651) is 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide is CCOC1(C(=O)NC[C@@H]2CCC[C@H]2O)CCCC1.
What is the InChIKey of 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide?
The InChIKey is JTZTVZLCYROJJM-NWDGAFQWSA-N. The full InChI is InChI=1S/C14H25NO3/c1-2-18-14(8-3-4-9-14)13(17)15-10-11-6-5-7-12(11)16/h11-12,16H,2-10H2,1H3,(H,15,17)/t11-,12+/m0/s1.
What are the key properties of 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide?
1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-[[(1S,2R)-2-hydroxycyclopentyl]methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 124732651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).