N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide

C15H23N3O — CID 103778222

IUPACN-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide
SMILESCNC(=O)C(C)NC1CCN(c2ccccc2)CC1
InChIInChI=1S/C15H23N3O/c1-12(15(19)16-2)17-13-8-10-18(11-9-13)14-6-4-3-5-7-14/h3-7,12-13,17H,8-11H2,1-2H3,(H,16,19)
InChIKeyRCIFUDAIMOEVHK-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.38
Rot. Bonds4

About N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide

N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide (PubChem CID 103778222) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide
PubChem CID103778222
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide
SMILESCNC(=O)C(C)NC1CCN(c2ccccc2)CC1
InChIInChI=1S/C15H23N3O/c1-12(15(19)16-2)17-13-8-10-18(11-9-13)14-6-4-3-5-7-14/h3-7,12-13,17H,8-11H2,1-2H3,(H,16,19)
InChIKeyRCIFUDAIMOEVHK-UHFFFAOYSA-N
XLogP1.38
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide?
The IUPAC name of N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide (CID 103778222) is N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide.
What is the SMILES notation for N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide?
The canonical SMILES for N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide is CNC(=O)C(C)NC1CCN(c2ccccc2)CC1.
What is the InChIKey of N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide?
The InChIKey is RCIFUDAIMOEVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12(15(19)16-2)17-13-8-10-18(11-9-13)14-6-4-3-5-7-14/h3-7,12-13,17H,8-11H2,1-2H3,(H,16,19).
What are the key properties of N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide?
N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide has a molecular weight of 261.37 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(1-phenylpiperidin-4-yl)amino]propanamide is sourced from PubChem (CID 103778222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).