5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide

C16H36N4O — CID 103191019

IUPAC5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CCCN(CC)C(C)CN(C)C)C(N)=O
InChIInChI=1S/C16H36N4O/c1-7-11-18-16(4,15(17)21)10-9-12-20(8-2)14(3)13-19(5)6/h14,18H,7-13H2,1-6H3,(H2,17,21)
InChIKeyUNSOLQORPKTQCG-UHFFFAOYSA-N
MW300.49 g/mol
LogP1.28
Rot. Bonds12

About 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide

5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide (PubChem CID 103191019) has the molecular formula C16H36N4O and a molecular weight of 300.49 g/mol. Its IUPAC name is 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide.

Molecular Properties

Compound Name5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide
PubChem CID103191019
Molecular FormulaC16H36N4O
Molecular Weight300.49 g/mol
Exact Mass300.29
IUPAC Name5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CCCN(CC)C(C)CN(C)C)C(N)=O
InChIInChI=1S/C16H36N4O/c1-7-11-18-16(4,15(17)21)10-9-12-20(8-2)14(3)13-19(5)6/h14,18H,7-13H2,1-6H3,(H2,17,21)
InChIKeyUNSOLQORPKTQCG-UHFFFAOYSA-N
XLogP1.28
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.49
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide?
The IUPAC name of 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide (CID 103191019) is 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide.
What is the SMILES notation for 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide?
The canonical SMILES for 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide is CCCNC(C)(CCCN(CC)C(C)CN(C)C)C(N)=O.
What is the InChIKey of 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide?
The InChIKey is UNSOLQORPKTQCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36N4O/c1-7-11-18-16(4,15(17)21)10-9-12-20(8-2)14(3)13-19(5)6/h14,18H,7-13H2,1-6H3,(H2,17,21).
What are the key properties of 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide?
5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide has a molecular weight of 300.49 g/mol, XLogP of 1.28, 12 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methyl-2-(propylamino)pentanamide is sourced from PubChem (CID 103191019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).