2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide

C22H32N4O — CID 134108320

IUPAC2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide
SMILESCN(C)CCCN1CCN(CC(=O)NCc2cccc3ccccc23)CC1
InChIInChI=1S/C22H32N4O/c1-24(2)11-6-12-25-13-15-26(16-14-25)18-22(27)23-17-20-9-5-8-19-7-3-4-10-21(19)20/h3-5,7-10H,6,11-18H2,1-2H3,(H,23,27)
InChIKeyKHEMZRPDBCTHRZ-UHFFFAOYSA-N
MW368.52 g/mol
LogP2.03
Rot. Bonds8

About 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide

2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide (PubChem CID 134108320) has the molecular formula C22H32N4O and a molecular weight of 368.52 g/mol. Its IUPAC name is 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide
PubChem CID134108320
Molecular FormulaC22H32N4O
Molecular Weight368.52 g/mol
Exact Mass368.26
IUPAC Name2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide
SMILESCN(C)CCCN1CCN(CC(=O)NCc2cccc3ccccc23)CC1
InChIInChI=1S/C22H32N4O/c1-24(2)11-6-12-25-13-15-26(16-14-25)18-22(27)23-17-20-9-5-8-19-7-3-4-10-21(19)20/h3-5,7-10H,6,11-18H2,1-2H3,(H,23,27)
InChIKeyKHEMZRPDBCTHRZ-UHFFFAOYSA-N
XLogP2.03
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.52
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide
CID 31001505
N-(naphthalen-1-ylmethyl)-2-piperazin-1-ylacetamide;2,2,2-trifluoroacetic acid
CID 172895290
N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-1-ylacetamide
CID 111429650
4-[2-(ethylamino)-2-oxoethyl]-N-(2-naphthalen-1-ylethyl)piperazine-1-carboxamide
CID 38381542
(2R)-2-[[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetyl]amino]-N-propylpropanamide
CID 8804679
1-[[4-[(benzylamino)methyl]phenyl]methyl]-1-(3-morpholin-4-ylpropyl)-3-(naphthalen-1-ylmethyl)urea
CID 59826221
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
CID 8901770
N-methyl-2-[4-(naphthalen-1-ylmethylamino)piperidin-1-yl]acetamide;hydrochloride
CID 51079563
N-[3-(dimethylamino)propyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 108995187
2-(ethylamino)-N-(naphthalen-1-ylmethyl)acetamide
CID 55068383
N-[(2-fluorophenyl)methyl]-2-[4-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1,4-diazepan-1-yl]acetamide
CID 31313746
N-[(4R)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide
CID 30639631

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide?
The IUPAC name of 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide (CID 134108320) is 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide.
What is the SMILES notation for 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide?
The canonical SMILES for 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide is CN(C)CCCN1CCN(CC(=O)NCc2cccc3ccccc23)CC1.
What is the InChIKey of 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide?
The InChIKey is KHEMZRPDBCTHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N4O/c1-24(2)11-6-12-25-13-15-26(16-14-25)18-22(27)23-17-20-9-5-8-19-7-3-4-10-21(19)20/h3-5,7-10H,6,11-18H2,1-2H3,(H,23,27).
What are the key properties of 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide?
2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide has a molecular weight of 368.52 g/mol, XLogP of 2.03, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(dimethylamino)propyl]piperazin-1-yl]-N-(naphthalen-1-ylmethyl)acetamide is sourced from PubChem (CID 134108320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).