N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide

C15H22N2O2 — CID 112513577

IUPACN-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1CC(C)NC1CC1
InChIInChI=1S/C15H22N2O2/c1-10(16-13-4-5-13)8-12-9-14(17-11(2)18)6-7-15(12)19-3/h6-7,9-10,13,16H,4-5,8H2,1-3H3,(H,17,18)
InChIKeyPKGDQBCLCPLFLL-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.34
Rot. Bonds6

About N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide

N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide (PubChem CID 112513577) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide
PubChem CID112513577
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1CC(C)NC1CC1
InChIInChI=1S/C15H22N2O2/c1-10(16-13-4-5-13)8-12-9-14(17-11(2)18)6-7-15(12)19-3/h6-7,9-10,13,16H,4-5,8H2,1-3H3,(H,17,18)
InChIKeyPKGDQBCLCPLFLL-UHFFFAOYSA-N
XLogP2.34
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-acetamido-2-methoxyphenyl)-2-aminopropanoic acid
CID 82481451
N-[3-(hydroxymethyl)-4-methoxyphenyl]acetamide
CID 82469130
N-[4-methoxy-3-[(propan-2-ylamino)methyl]phenyl]acetamide
CID 96661325
2-(5-acetamido-2-methoxyphenyl)acetamide
CID 82494406
N-[3-(3-aminopropyl)-4-methoxyphenyl]acetamide
CID 96659275
N-[(5-acetamido-2-methoxyphenyl)methyl]-3-methylbutanamide
CID 110784111
N-[3-(cyclopropylcarbamoylamino)-4-methoxyphenyl]acetamide
CID 47127639
N-(4-methoxy-3-methylsulfanylphenyl)acetamide
CID 593064
N-(3-ethyl-4-propan-2-yloxyphenyl)acetamide
CID 66916731
N-[1-(2-methoxyphenyl)propan-2-yl]-3-methylcyclopentan-1-amine
CID 64501539
N-cyclopropyl-2-[1-(2-methoxyphenyl)propan-2-ylamino]acetamide
CID 43777963
N-(4-acetamido-3-methoxyphenyl)-2-methoxypropanamide
CID 47308212

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide?
The IUPAC name of N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide (CID 112513577) is N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide.
What is the SMILES notation for N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide?
The canonical SMILES for N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide is COc1ccc(NC(C)=O)cc1CC(C)NC1CC1.
What is the InChIKey of N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide?
The InChIKey is PKGDQBCLCPLFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10(16-13-4-5-13)8-12-9-14(17-11(2)18)6-7-15(12)19-3/h6-7,9-10,13,16H,4-5,8H2,1-3H3,(H,17,18).
What are the key properties of N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide?
N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(cyclopropylamino)propyl]-4-methoxyphenyl]acetamide is sourced from PubChem (CID 112513577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).