N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine

C23H48N4 — CID 19107822

IUPACN,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine
SMILESCC1(C)CC(NCCCCCNC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C23H48N4/c1-20(2)14-18(15-21(3,4)26-20)24-12-10-9-11-13-25-19-16-22(5,6)27-23(7,8)17-19/h18-19,24-27H,9-17H2,1-8H3
InChIKeyCVVVRDVGVPWPRM-UHFFFAOYSA-N
MW380.67 g/mol
LogP3.95
Rot. Bonds8

About N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine

N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine (PubChem CID 19107822) has the molecular formula C23H48N4 and a molecular weight of 380.67 g/mol. Its IUPAC name is N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine.

Molecular Properties

Compound NameN,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine
PubChem CID19107822
Molecular FormulaC23H48N4
Molecular Weight380.67 g/mol
Exact Mass380.39
IUPAC NameN,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine
SMILESCC1(C)CC(NCCCCCNC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C23H48N4/c1-20(2)14-18(15-21(3,4)26-20)24-12-10-9-11-13-25-19-16-22(5,6)27-23(7,8)17-19/h18-19,24-27H,9-17H2,1-8H3
InChIKeyCVVVRDVGVPWPRM-UHFFFAOYSA-N
XLogP3.95
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.67
LogP ≤ 53.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine?
The IUPAC name of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine (CID 19107822) is N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine.
What is the SMILES notation for N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine?
The canonical SMILES for N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine is CC1(C)CC(NCCCCCNC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine?
The InChIKey is CVVVRDVGVPWPRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48N4/c1-20(2)14-18(15-21(3,4)26-20)24-12-10-9-11-13-25-19-16-22(5,6)27-23(7,8)17-19/h18-19,24-27H,9-17H2,1-8H3.
What are the key properties of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine?
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine has a molecular weight of 380.67 g/mol, XLogP of 3.95, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)pentane-1,5-diamine is sourced from PubChem (CID 19107822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).