2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide

C14H26N2O2 — CID 141152203

IUPAC2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide
SMILESCN(CC1CCNC1)C(=O)CC1(O)CCCCC1
InChIInChI=1S/C14H26N2O2/c1-16(11-12-5-8-15-10-12)13(17)9-14(18)6-3-2-4-7-14/h12,15,18H,2-11H2,1H3
InChIKeyFZVDQFJMAISXKC-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.14
Rot. Bonds4

About 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide

2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide (PubChem CID 141152203) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide
PubChem CID141152203
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide
SMILESCN(CC1CCNC1)C(=O)CC1(O)CCCCC1
InChIInChI=1S/C14H26N2O2/c1-16(11-12-5-8-15-10-12)13(17)9-14(18)6-3-2-4-7-14/h12,15,18H,2-11H2,1H3
InChIKeyFZVDQFJMAISXKC-UHFFFAOYSA-N
XLogP1.14
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide?
The IUPAC name of 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide (CID 141152203) is 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide is CN(CC1CCNC1)C(=O)CC1(O)CCCCC1.
What is the InChIKey of 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide?
The InChIKey is FZVDQFJMAISXKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-16(11-12-5-8-15-10-12)13(17)9-14(18)6-3-2-4-7-14/h12,15,18H,2-11H2,1H3.
What are the key properties of 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide?
2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide has a molecular weight of 254.37 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclohexyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)acetamide is sourced from PubChem (CID 141152203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).