1-(4-methylpiperazin-1-yl)hexan-2-amine

C11H25N3 — CID 60853142

IUPAC1-(4-methylpiperazin-1-yl)hexan-2-amine
SMILESCCCCC(N)CN1CCN(C)CC1
InChIInChI=1S/C11H25N3/c1-3-4-5-11(12)10-14-8-6-13(2)7-9-14/h11H,3-10,12H2,1-2H3
InChIKeyNKOLXRLMDLXSIT-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.75
Rot. Bonds5

About 1-(4-methylpiperazin-1-yl)hexan-2-amine

1-(4-methylpiperazin-1-yl)hexan-2-amine (PubChem CID 60853142) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)hexan-2-amine.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)hexan-2-amine
PubChem CID60853142
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC Name1-(4-methylpiperazin-1-yl)hexan-2-amine
SMILESCCCCC(N)CN1CCN(C)CC1
InChIInChI=1S/C11H25N3/c1-3-4-5-11(12)10-14-8-6-13(2)7-9-14/h11H,3-10,12H2,1-2H3
InChIKeyNKOLXRLMDLXSIT-UHFFFAOYSA-N
XLogP0.75
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-methylpiperazin-1-yl)hexan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-butylpiperazin-1-yl)pentan-2-amine
CID 102550775
1-morpholin-4-ylhexan-2-amine
CID 60852253
1-(4-propan-2-ylpiperidin-1-yl)hexan-2-amine
CID 103497519
(2S)-1-(4-propylpiperazin-1-yl)pentan-2-amine
CID 93255682
1-(3,4,5-trimethylpiperazin-1-yl)hexan-2-amine
CID 114547111
4-amino-5-(4-methylpiperazin-1-yl)pentanamide
CID 58079559
1-(3,6-dihydro-2H-pyridin-1-yl)hexan-2-amine
CID 114410564
2-[(4-methylpiperazin-1-yl)methyl]hexanoic acid
CID 142749204
1-(3,4-dihydro-1H-isoquinolin-2-yl)hexan-2-amine
CID 60854585
1-(4-methyl-1,4-diazepan-1-yl)-4-methylsulfanylbutan-2-amine
CID 102550722
1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)hexan-2-amine
CID 115560295
1-piperidin-1-ylpentan-2-amine
CID 43650435

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)hexan-2-amine?
The IUPAC name of 1-(4-methylpiperazin-1-yl)hexan-2-amine (CID 60853142) is 1-(4-methylpiperazin-1-yl)hexan-2-amine.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)hexan-2-amine?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)hexan-2-amine is CCCCC(N)CN1CCN(C)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)hexan-2-amine?
The InChIKey is NKOLXRLMDLXSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-3-4-5-11(12)10-14-8-6-13(2)7-9-14/h11H,3-10,12H2,1-2H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)hexan-2-amine?
1-(4-methylpiperazin-1-yl)hexan-2-amine has a molecular weight of 199.34 g/mol, XLogP of 0.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)hexan-2-amine is sourced from PubChem (CID 60853142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).