N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide

C19H30N4O — CID 120557201

IUPACN-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide
SMILESCC1CNCCC1NC(=O)CCN1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H30N4O/c1-16-15-20-9-7-18(16)21-19(24)8-10-22-11-13-23(14-12-22)17-5-3-2-4-6-17/h2-6,16,18,20H,7-15H2,1H3,(H,21,24)
InChIKeyVZMTVMQYZRRTQJ-UHFFFAOYSA-N
MW330.48 g/mol
LogP1.31
Rot. Bonds5

About N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide

N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide (PubChem CID 120557201) has the molecular formula C19H30N4O and a molecular weight of 330.48 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide
PubChem CID120557201
Molecular FormulaC19H30N4O
Molecular Weight330.48 g/mol
Exact Mass330.24
IUPAC NameN-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide
SMILESCC1CNCCC1NC(=O)CCN1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H30N4O/c1-16-15-20-9-7-18(16)21-19(24)8-10-22-11-13-23(14-12-22)17-5-3-2-4-6-17/h2-6,16,18,20H,7-15H2,1H3,(H,21,24)
InChIKeyVZMTVMQYZRRTQJ-UHFFFAOYSA-N
XLogP1.31
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylpiperidin-4-yl)-2-phenylacetamide;hydrochloride
CID 120553778
3-(3-methyl-2-oxobenzimidazol-1-yl)-N-(3-methylpiperidin-4-yl)propanamide
CID 120557615
N-methyl-3-(4-phenylpiperazin-1-yl)-N-pyrrolidin-3-ylpropanamide
CID 119554014
N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide
CID 79886279
N-(3-methylpiperidin-4-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide;hydrochloride
CID 120554902
N-(3-methylpiperidin-4-yl)-3-phenylmethoxypropanamide
CID 120554516
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-3-(4-phenylpiperazin-1-yl)propanamide
CID 167934556
3-(2-methylphenyl)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120556745
2-[4-(3-methylphenyl)piperazin-1-yl]sulfonyl-N-(3-methylpiperidin-4-yl)acetamide;dihydrochloride
CID 120555368
N-(3-methylpiperidin-4-yl)-4-(2-phenylethoxy)butanamide;hydrochloride
CID 120555490
2-(2-methylphenyl)-N-(3-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120557156
2-(2-methylphenyl)sulfanyl-N-(3-methylpiperidin-4-yl)acetamide
CID 120556800

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide?
The IUPAC name of N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide (CID 120557201) is N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide is CC1CNCCC1NC(=O)CCN1CCN(c2ccccc2)CC1.
What is the InChIKey of N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide?
The InChIKey is VZMTVMQYZRRTQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O/c1-16-15-20-9-7-18(16)21-19(24)8-10-22-11-13-23(14-12-22)17-5-3-2-4-6-17/h2-6,16,18,20H,7-15H2,1H3,(H,21,24).
What are the key properties of N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide?
N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide has a molecular weight of 330.48 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)-3-(4-phenylpiperazin-1-yl)propanamide is sourced from PubChem (CID 120557201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).