N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine

C16H35N3 — CID 63265554

IUPACN-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine
SMILESCCCCCCCCCN(C)CCN1CCNCC1
InChIInChI=1S/C16H35N3/c1-3-4-5-6-7-8-9-12-18(2)15-16-19-13-10-17-11-14-19/h17H,3-16H2,1-2H3
InChIKeyZBNCYLFYDRSYPE-UHFFFAOYSA-N
MW269.48 g/mol
LogP2.57
Rot. Bonds11

About N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine

N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine (PubChem CID 63265554) has the molecular formula C16H35N3 and a molecular weight of 269.48 g/mol. Its IUPAC name is N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine.

Molecular Properties

Compound NameN-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine
PubChem CID63265554
Molecular FormulaC16H35N3
Molecular Weight269.48 g/mol
Exact Mass269.28
IUPAC NameN-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine
SMILESCCCCCCCCCN(C)CCN1CCNCC1
InChIInChI=1S/C16H35N3/c1-3-4-5-6-7-8-9-12-18(2)15-16-19-13-10-17-11-14-19/h17H,3-16H2,1-2H3
InChIKeyZBNCYLFYDRSYPE-UHFFFAOYSA-N
XLogP2.57
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.48
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-piperazin-1-ylethyl)-N,N'-di(tetradecyl)-N-tridecylethane-1,2-diamine
CID 171538757
N,N,N'-trimethyl-N'-(2-piperazin-1-ylethyl)propane-1,3-diamine
CID 63695224
1-tricosylpiperazine
CID 130183651
3-ethylsulfonyl-N-methyl-N-(2-piperazin-1-ylethyl)propan-1-amine
CID 65098202
ethane;1-octylpiperazine
CID 144711845
diazanium;1-docosylpiperazine;dibromide
CID 157305429
N-[2-[4-[2-[methyl(pentyl)amino]ethyl]piperazin-1-yl]ethyl]heptan-1-amine
CID 143882413
N,N'-dimethyl-N'-[2-[methyl(2-piperazin-1-ylethyl)amino]ethyl]ethane-1,2-diamine
CID 126510399
N-methyl-N-pentacosylpentacosan-1-amine
CID 118952569
N-hexadecyl-N-methylicosan-1-amine
CID 21242596
N,N'-dimethyl-N,N'-dioctyldecane-1,10-diamine
CID 19772875
N-hexyl-N-methyldodecan-1-amine
CID 139978744

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine?
The IUPAC name of N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine (CID 63265554) is N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine.
What is the SMILES notation for N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine?
The canonical SMILES for N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine is CCCCCCCCCN(C)CCN1CCNCC1.
What is the InChIKey of N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine?
The InChIKey is ZBNCYLFYDRSYPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3/c1-3-4-5-6-7-8-9-12-18(2)15-16-19-13-10-17-11-14-19/h17H,3-16H2,1-2H3.
What are the key properties of N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine?
N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine has a molecular weight of 269.48 g/mol, XLogP of 2.57, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine is sourced from PubChem (CID 63265554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).