N-(2-cyanopropyl)-2-morpholin-2-ylacetamide

C10H17N3O2 — CID 66426825

IUPACN-(2-cyanopropyl)-2-morpholin-2-ylacetamide
SMILESCC(C#N)CNC(=O)CC1CNCCO1
InChIInChI=1S/C10H17N3O2/c1-8(5-11)6-13-10(14)4-9-7-12-2-3-15-9/h8-9,12H,2-4,6-7H2,1H3,(H,13,14)
InChIKeyMFMFFZAFCAVANK-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.36
Rot. Bonds4

About N-(2-cyanopropyl)-2-morpholin-2-ylacetamide

N-(2-cyanopropyl)-2-morpholin-2-ylacetamide (PubChem CID 66426825) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(2-cyanopropyl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-cyanopropyl)-2-morpholin-2-ylacetamide
PubChem CID66426825
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-(2-cyanopropyl)-2-morpholin-2-ylacetamide
SMILESCC(C#N)CNC(=O)CC1CNCCO1
InChIInChI=1S/C10H17N3O2/c1-8(5-11)6-13-10(14)4-9-7-12-2-3-15-9/h8-9,12H,2-4,6-7H2,1H3,(H,13,14)
InChIKeyMFMFFZAFCAVANK-UHFFFAOYSA-N
XLogP-0.36
TPSA74.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyanopropyl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(2-cyanopropyl)-2-morpholin-2-ylacetamide (CID 66426825) is N-(2-cyanopropyl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(2-cyanopropyl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(2-cyanopropyl)-2-morpholin-2-ylacetamide is CC(C#N)CNC(=O)CC1CNCCO1.
What is the InChIKey of N-(2-cyanopropyl)-2-morpholin-2-ylacetamide?
The InChIKey is MFMFFZAFCAVANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-8(5-11)6-13-10(14)4-9-7-12-2-3-15-9/h8-9,12H,2-4,6-7H2,1H3,(H,13,14).
What are the key properties of N-(2-cyanopropyl)-2-morpholin-2-ylacetamide?
N-(2-cyanopropyl)-2-morpholin-2-ylacetamide has a molecular weight of 211.26 g/mol, XLogP of -0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanopropyl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66426825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).