N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide

C14H28N2O — CID 43136622

IUPACN-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide
SMILESCC(C)N(CCCN)C(=O)CC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-12(2)16(10-6-9-15)14(17)11-13-7-4-3-5-8-13/h12-13H,3-11,15H2,1-2H3
InChIKeyZSFNHFFICBXWDW-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.54
Rot. Bonds6

About N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide

N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide (PubChem CID 43136622) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide
PubChem CID43136622
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide
SMILESCC(C)N(CCCN)C(=O)CC1CCCCC1
InChIInChI=1S/C14H28N2O/c1-12(2)16(10-6-9-15)14(17)11-13-7-4-3-5-8-13/h12-13H,3-11,15H2,1-2H3
InChIKeyZSFNHFFICBXWDW-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide?
The IUPAC name of N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide (CID 43136622) is N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide.
What is the SMILES notation for N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide?
The canonical SMILES for N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide is CC(C)N(CCCN)C(=O)CC1CCCCC1.
What is the InChIKey of N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide?
The InChIKey is ZSFNHFFICBXWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(2)16(10-6-9-15)14(17)11-13-7-4-3-5-8-13/h12-13H,3-11,15H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide?
N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide has a molecular weight of 240.39 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-cyclohexyl-N-propan-2-ylacetamide is sourced from PubChem (CID 43136622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).