2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide

C20H24N2O2 — CID 119810548

IUPAC2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide
SMILESCc1c(COc2ccccc2)cccc1NC(=O)CNCC1CC1
InChIInChI=1S/C20H24N2O2/c1-15-17(14-24-18-7-3-2-4-8-18)6-5-9-19(15)22-20(23)13-21-12-16-10-11-16/h2-9,16,21H,10-14H2,1H3,(H,22,23)
InChIKeyBPHZVAMEXBEXTE-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.51
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide

2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide (PubChem CID 119810548) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide
PubChem CID119810548
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide
SMILESCc1c(COc2ccccc2)cccc1NC(=O)CNCC1CC1
InChIInChI=1S/C20H24N2O2/c1-15-17(14-24-18-7-3-2-4-8-18)6-5-9-19(15)22-20(23)13-21-12-16-10-11-16/h2-9,16,21H,10-14H2,1H3,(H,22,23)
InChIKeyBPHZVAMEXBEXTE-UHFFFAOYSA-N
XLogP3.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide;hydrochloride
CID 119810549
2-amino-N-[2-methyl-3-(phenoxymethyl)phenyl]-2-(oxan-4-yl)acetamide
CID 120795542
1-(2-hydroxyethyl)-3-[2-methyl-3-(phenoxymethyl)phenyl]urea
CID 71865833
3-[[2-(cyclopropylmethylamino)acetyl]amino]-2-methylbenzamide
CID 54925416
(2S,5R)-5-(aminomethyl)-N-[2-methyl-3-(phenoxymethyl)phenyl]oxolane-2-carboxamide
CID 120795540
2-(cyclopropylmethylamino)-N-[2-(2-methoxyethyl)phenyl]acetamide
CID 102905776
2-(cyclopropylmethylamino)-N-(4-phenylmethoxyphenyl)acetamide;hydrochloride
CID 119669315
2-(cyclopropylmethylamino)-N-[2-methyl-3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119709174
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 60867454
(2S)-2-amino-4-methyl-N-[2-methyl-3-(phenoxymethyl)phenyl]pentanamide;hydrochloride
CID 119810569
2-(cyclopropylmethylamino)-N-(2-phenylphenyl)acetamide;hydrochloride
CID 119675331
2-(cyclopropylmethylamino)-N-(2,3-dichlorophenyl)acetamide
CID 60843168

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide (CID 119810548) is 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide is Cc1c(COc2ccccc2)cccc1NC(=O)CNCC1CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide?
The InChIKey is BPHZVAMEXBEXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15-17(14-24-18-7-3-2-4-8-18)6-5-9-19(15)22-20(23)13-21-12-16-10-11-16/h2-9,16,21H,10-14H2,1H3,(H,22,23).
What are the key properties of 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide?
2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide has a molecular weight of 324.42 g/mol, XLogP of 3.51, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[2-methyl-3-(phenoxymethyl)phenyl]acetamide is sourced from PubChem (CID 119810548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).