2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide

C17H24N2O3 — CID 119712735

IUPAC2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide
SMILESO=C(CNCC1CC1)Nc1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C17H24N2O3/c20-17(11-18-10-13-3-4-13)19-14-5-7-15(8-6-14)22-12-16-2-1-9-21-16/h5-8,13,16,18H,1-4,9-12H2,(H,19,20)
InChIKeyUVORGWWIXUYPGK-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.18
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide

2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide (PubChem CID 119712735) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide
PubChem CID119712735
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide
SMILESO=C(CNCC1CC1)Nc1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C17H24N2O3/c20-17(11-18-10-13-3-4-13)19-14-5-7-15(8-6-14)22-12-16-2-1-9-21-16/h5-8,13,16,18H,1-4,9-12H2,(H,19,20)
InChIKeyUVORGWWIXUYPGK-UHFFFAOYSA-N
XLogP2.18
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide (CID 119712735) is 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide is O=C(CNCC1CC1)Nc1ccc(OCC2CCCO2)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide?
The InChIKey is UVORGWWIXUYPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-17(11-18-10-13-3-4-13)19-14-5-7-15(8-6-14)22-12-16-2-1-9-21-16/h5-8,13,16,18H,1-4,9-12H2,(H,19,20).
What are the key properties of 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide?
2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide has a molecular weight of 304.39 g/mol, XLogP of 2.18, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[4-(oxolan-2-ylmethoxy)phenyl]acetamide is sourced from PubChem (CID 119712735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).