2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide

C10H18N2O — CID 116674271

IUPAC2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide
SMILESCC(C(=O)NCC1CC1)C1CNC1
InChIInChI=1S/C10H18N2O/c1-7(9-5-11-6-9)10(13)12-4-8-2-3-8/h7-9,11H,2-6H2,1H3,(H,12,13)
InChIKeyDSXIQUPBWVHHMS-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.37
Rot. Bonds4

About 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide

2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide (PubChem CID 116674271) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide
PubChem CID116674271
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide
SMILESCC(C(=O)NCC1CC1)C1CNC1
InChIInChI=1S/C10H18N2O/c1-7(9-5-11-6-9)10(13)12-4-8-2-3-8/h7-9,11H,2-6H2,1H3,(H,12,13)
InChIKeyDSXIQUPBWVHHMS-UHFFFAOYSA-N
XLogP0.37
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide (CID 116674271) is 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide is CC(C(=O)NCC1CC1)C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide?
The InChIKey is DSXIQUPBWVHHMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7(9-5-11-6-9)10(13)12-4-8-2-3-8/h7-9,11H,2-6H2,1H3,(H,12,13).
What are the key properties of 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide?
2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide has a molecular weight of 182.27 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(cyclopropylmethyl)propanamide is sourced from PubChem (CID 116674271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).