N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide

C15H22N2O — CID 122188349

IUPACN-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide
SMILESCCCN1c2ccccc2CCC1CNC(C)=O
InChIInChI=1S/C15H22N2O/c1-3-10-17-14(11-16-12(2)18)9-8-13-6-4-5-7-15(13)17/h4-7,14H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyNNJCGZMXZHXDFT-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.35
Rot. Bonds4

About N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide

N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide (PubChem CID 122188349) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide
PubChem CID122188349
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide
SMILESCCCN1c2ccccc2CCC1CNC(C)=O
InChIInChI=1S/C15H22N2O/c1-3-10-17-14(11-16-12(2)18)9-8-13-6-4-5-7-15(13)17/h4-7,14H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyNNJCGZMXZHXDFT-UHFFFAOYSA-N
XLogP2.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide?
The IUPAC name of N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide (CID 122188349) is N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide.
What is the SMILES notation for N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide?
The canonical SMILES for N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide is CCCN1c2ccccc2CCC1CNC(C)=O.
What is the InChIKey of N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide?
The InChIKey is NNJCGZMXZHXDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-10-17-14(11-16-12(2)18)9-8-13-6-4-5-7-15(13)17/h4-7,14H,3,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide?
N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide has a molecular weight of 246.35 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-propyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide is sourced from PubChem (CID 122188349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).