N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide

C21H34N4O2 — CID 120889437

IUPACN-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide
SMILESCOCC1(CNC(=O)CCN2CCN(c3ccccc3)CC2)CCNCC1
InChIInChI=1S/C21H34N4O2/c1-27-18-21(8-10-22-11-9-21)17-23-20(26)7-12-24-13-15-25(16-14-24)19-5-3-2-4-6-19/h2-6,22H,7-18H2,1H3,(H,23,26)
InChIKeyGZSGCSFRGXHFDR-UHFFFAOYSA-N
MW374.53 g/mol
LogP1.33
Rot. Bonds8

About N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide

N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide (PubChem CID 120889437) has the molecular formula C21H34N4O2 and a molecular weight of 374.53 g/mol. Its IUPAC name is N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide
PubChem CID120889437
Molecular FormulaC21H34N4O2
Molecular Weight374.53 g/mol
Exact Mass374.27
IUPAC NameN-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide
SMILESCOCC1(CNC(=O)CCN2CCN(c3ccccc3)CC2)CCNCC1
InChIInChI=1S/C21H34N4O2/c1-27-18-21(8-10-22-11-9-21)17-23-20(26)7-12-24-13-15-25(16-14-24)19-5-3-2-4-6-19/h2-6,22H,7-18H2,1H3,(H,23,26)
InChIKeyGZSGCSFRGXHFDR-UHFFFAOYSA-N
XLogP1.33
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3,3-diphenylpropanamide
CID 120888993
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-oxocinnolin-1-yl)propanamide
CID 120887565
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 120891919
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-phenacylsulfanylacetamide;hydrochloride
CID 120892025
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-1-phenylpyrazole-4-carboxamide
CID 120888288
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-phenyltriazole-4-carboxamide
CID 120887619
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(triazol-1-yl)propanamide
CID 120889885
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-1-phenyltriazole-4-carboxamide;hydrochloride
CID 120890524
3-(4-chlorophenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]propanamide
CID 120890837
2,2-difluoro-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-phenylacetamide
CID 120888865
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-morpholin-4-yl-4-oxobutanamide
CID 120888945
N-[2-(4-methoxyphenyl)ethyl]-3-(4-phenylpiperazin-1-yl)propanamide
CID 109025748

Frequently Asked Questions

What is the IUPAC name of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide?
The IUPAC name of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide (CID 120889437) is N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide?
The canonical SMILES for N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide is COCC1(CNC(=O)CCN2CCN(c3ccccc3)CC2)CCNCC1.
What is the InChIKey of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide?
The InChIKey is GZSGCSFRGXHFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H34N4O2/c1-27-18-21(8-10-22-11-9-21)17-23-20(26)7-12-24-13-15-25(16-14-24)19-5-3-2-4-6-19/h2-6,22H,7-18H2,1H3,(H,23,26).
What are the key properties of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide?
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide has a molecular weight of 374.53 g/mol, XLogP of 1.33, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-(4-phenylpiperazin-1-yl)propanamide is sourced from PubChem (CID 120889437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).