2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide

C12H23N3O3 — CID 131914362

IUPAC2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide
SMILESCN(C)C(=O)NCC(=O)NCCC1(O)CCCC1
InChIInChI=1S/C12H23N3O3/c1-15(2)11(17)14-9-10(16)13-8-7-12(18)5-3-4-6-12/h18H,3-9H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyBCFSFCAFCONEPE-UHFFFAOYSA-N
MW257.33 g/mol
LogP0.07
Rot. Bonds5

About 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide

2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide (PubChem CID 131914362) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide
PubChem CID131914362
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC Name2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide
SMILESCN(C)C(=O)NCC(=O)NCCC1(O)CCCC1
InChIInChI=1S/C12H23N3O3/c1-15(2)11(17)14-9-10(16)13-8-7-12(18)5-3-4-6-12/h18H,3-9H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyBCFSFCAFCONEPE-UHFFFAOYSA-N
XLogP0.07
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-hydroxycyclopentyl)ethyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide
CID 91835522
2-(1-aminocyclobutyl)-N-[2-(dimethylcarbamoylamino)ethyl]acetamide
CID 83112019
3-[(1-ethylcyclopentyl)methyl]-1,1-dimethylurea
CID 103764918
N-[(1-hydroxycyclopentyl)methyl]-2-(propylamino)acetamide
CID 65106366
3-[(3-hydroxypyrrolidin-3-yl)methyl]-1,1-dimethylurea
CID 114760994
6-[2-(1-hydroxycyclopentyl)ethylamino]-N,N-dimethylpyrazine-2-carboxamide
CID 131918436
2-(1-hydroxycyclohexyl)-N-[2-[methyl(propan-2-yl)amino]ethyl]acetamide
CID 111464650
1-[2-(ethylamino)ethyl]cyclopentan-1-ol
CID 121358963
N-[2-(dimethylcarbamoylamino)ethyl]propanamide
CID 83117545
1-cyano-N-[2-(dimethylcarbamoylamino)ethyl]cyclobutane-1-carboxamide
CID 83109882
N-ethyl-2-[(1-hydroxycycloheptyl)methylamino]acetamide
CID 60909353
2-[1-[(dimethylcarbamoylamino)methyl]cyclobutyl]acetic acid
CID 81164855

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide?
The IUPAC name of 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide (CID 131914362) is 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide.
What is the SMILES notation for 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide?
The canonical SMILES for 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide is CN(C)C(=O)NCC(=O)NCCC1(O)CCCC1.
What is the InChIKey of 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide?
The InChIKey is BCFSFCAFCONEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-15(2)11(17)14-9-10(16)13-8-7-12(18)5-3-4-6-12/h18H,3-9H2,1-2H3,(H,13,16)(H,14,17).
What are the key properties of 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide?
2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide has a molecular weight of 257.33 g/mol, XLogP of 0.07, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylcarbamoylamino)-N-[2-(1-hydroxycyclopentyl)ethyl]acetamide is sourced from PubChem (CID 131914362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).