N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide

C14H20N2O2 — CID 61399131

IUPACN-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
SMILESNCCCN(C(=O)Cc1cccc(O)c1)C1CC1
InChIInChI=1S/C14H20N2O2/c15-7-2-8-16(12-5-6-12)14(18)10-11-3-1-4-13(17)9-11/h1,3-4,9,12,17H,2,5-8,10,15H2
InChIKeyGQSHYQXXQNXJHS-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.27
Rot. Bonds6

About N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide

N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide (PubChem CID 61399131) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
PubChem CID61399131
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
SMILESNCCCN(C(=O)Cc1cccc(O)c1)C1CC1
InChIInChI=1S/C14H20N2O2/c15-7-2-8-16(12-5-6-12)14(18)10-11-3-1-4-13(17)9-11/h1,3-4,9,12,17H,2,5-8,10,15H2
InChIKeyGQSHYQXXQNXJHS-UHFFFAOYSA-N
XLogP1.27
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoethyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 80678119
N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 71935827
N-(3-aminopropyl)-N-cyclopropyl-2-(2-hydroxyphenyl)acetamide
CID 80744348
6-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]hexanamide
CID 60964131
N-(3-aminopropyl)-N-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 43136754
N-cyclopentyl-2-(3-hydroxyphenyl)-N-(3,3,3-trifluoropropyl)acetamide
CID 71968977
2-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]acetamide
CID 60964232
N-(3-aminopropyl)-N-cyclopropyl-2-(2-fluorophenyl)acetamide
CID 43136756
N-(2-aminoethyl)-N-cyclopentyl-2-(3-methylphenyl)acetamide
CID 63754808
N-(3-aminopropyl)-N-cyclobutyl-3-phenylpropanamide
CID 102873861
N-(2-chloroethyl)-N-cyclopropyl-2-phenylacetamide
CID 63394434
N-(2-aminoethyl)-N-cyclopropyl-3-hydroxybenzamide
CID 61349964

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide (CID 61399131) is N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide is NCCCN(C(=O)Cc1cccc(O)c1)C1CC1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
The InChIKey is GQSHYQXXQNXJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c15-7-2-8-16(12-5-6-12)14(18)10-11-3-1-4-13(17)9-11/h1,3-4,9,12,17H,2,5-8,10,15H2.
What are the key properties of N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 61399131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).