N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide

C19H38N4O — CID 75386858

IUPACN-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide
SMILESCC(C)CNC(=O)C(C)N1CCN(C2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C19H38N4O/c1-15(2)14-20-19(24)17(5)22-10-12-23(13-11-22)18-6-8-21(9-7-18)16(3)4/h15-18H,6-14H2,1-5H3,(H,20,24)
InChIKeyBILJRCCCRLLNAO-UHFFFAOYSA-N
MW338.54 g/mol
LogP1.64
Rot. Bonds6

About N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide

N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide (PubChem CID 75386858) has the molecular formula C19H38N4O and a molecular weight of 338.54 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide
PubChem CID75386858
Molecular FormulaC19H38N4O
Molecular Weight338.54 g/mol
Exact Mass338.30
IUPAC NameN-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide
SMILESCC(C)CNC(=O)C(C)N1CCN(C2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C19H38N4O/c1-15(2)14-20-19(24)17(5)22-10-12-23(13-11-22)18-6-8-21(9-7-18)16(3)4/h15-18H,6-14H2,1-5H3,(H,20,24)
InChIKeyBILJRCCCRLLNAO-UHFFFAOYSA-N
XLogP1.64
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.54
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide?
The IUPAC name of N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide (CID 75386858) is N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide is CC(C)CNC(=O)C(C)N1CCN(C2CCN(C(C)C)CC2)CC1.
What is the InChIKey of N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide?
The InChIKey is BILJRCCCRLLNAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N4O/c1-15(2)14-20-19(24)17(5)22-10-12-23(13-11-22)18-6-8-21(9-7-18)16(3)4/h15-18H,6-14H2,1-5H3,(H,20,24).
What are the key properties of N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide?
N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide has a molecular weight of 338.54 g/mol, XLogP of 1.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide is sourced from PubChem (CID 75386858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).