2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide

C17H26N2O2 — CID 119819945

IUPAC2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide
SMILESCCC(CNC(=O)CNCC1CC1)Oc1ccccc1C
InChIInChI=1S/C17H26N2O2/c1-3-15(21-16-7-5-4-6-13(16)2)11-19-17(20)12-18-10-14-8-9-14/h4-7,14-15,18H,3,8-12H2,1-2H3,(H,19,20)
InChIKeyXVKBIAJJAKNUQD-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.27
Rot. Bonds9

About 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide

2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide (PubChem CID 119819945) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide
PubChem CID119819945
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide
SMILESCCC(CNC(=O)CNCC1CC1)Oc1ccccc1C
InChIInChI=1S/C17H26N2O2/c1-3-15(21-16-7-5-4-6-13(16)2)11-19-17(20)12-18-10-14-8-9-14/h4-7,14-15,18H,3,8-12H2,1-2H3,(H,19,20)
InChIKeyXVKBIAJJAKNUQD-UHFFFAOYSA-N
XLogP2.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[2-(2-methylphenoxy)butyl]cyclopentane-1-carboxamide;hydrochloride
CID 119819930
2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119742933
2-(cyclopropylmethylamino)-N-[3-(2-methylphenoxy)propyl]acetamide;hydrochloride
CID 119772272
3-amino-N-[2-(2-methylphenoxy)butyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119819932
(2S)-2-amino-3,3-dimethyl-N-[2-(2-methylphenoxy)butyl]butanamide
CID 119819943
2-(cyclopropylmethylamino)-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 119730492
N-[2-(2-chlorophenoxy)butyl]-2-(methylamino)acetamide
CID 119813227
2-(cyclopropylmethylamino)-N-[2-(2-methylphenyl)ethyl]acetamide;hydrochloride
CID 119688191
2-methyl-1-[2-(2-methylphenoxy)butyl]guanidine;hydroiodide
CID 111800301
2-(cyclopropylmethylamino)-N-(2-hydroxy-2-phenylethyl)acetamide;hydrochloride
CID 119676983
1-[4-(ethylaminomethyl)piperidin-1-yl]-2-(2-methylphenoxy)butan-1-one;hydrochloride
CID 119648473
2,2-dimethyl-N-[2-[2-(2-methylphenoxy)propylamino]-2-oxoethyl]propanamide
CID 71998406

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide (CID 119819945) is 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide is CCC(CNC(=O)CNCC1CC1)Oc1ccccc1C.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide?
The InChIKey is XVKBIAJJAKNUQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-15(21-16-7-5-4-6-13(16)2)11-19-17(20)12-18-10-14-8-9-14/h4-7,14-15,18H,3,8-12H2,1-2H3,(H,19,20).
What are the key properties of 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide?
2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide has a molecular weight of 290.41 g/mol, XLogP of 2.27, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)butyl]acetamide is sourced from PubChem (CID 119819945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).