N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine

C14H30N2 — CID 62196752

IUPACN-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine
SMILESCCCCC(C)NC(C)C1CCN(C)CC1
InChIInChI=1S/C14H30N2/c1-5-6-7-12(2)15-13(3)14-8-10-16(4)11-9-14/h12-15H,5-11H2,1-4H3
InChIKeyDEDMLJIVMWDVNS-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds6

About N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine

N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine (PubChem CID 62196752) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine.

Molecular Properties

Compound NameN-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine
PubChem CID62196752
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine
SMILESCCCCC(C)NC(C)C1CCN(C)CC1
InChIInChI=1S/C14H30N2/c1-5-6-7-12(2)15-13(3)14-8-10-16(4)11-9-14/h12-15H,5-11H2,1-4H3
InChIKeyDEDMLJIVMWDVNS-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(1-methylpiperidin-4-yl)ethyl]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

N-(1-cyclopropylethyl)hexan-2-amine
CID 43776552
4-methoxy-N-[1-(1-methylpiperidin-4-yl)ethyl]butan-2-amine
CID 64604411
N-[1-(1-methylpiperidin-4-yl)ethyl]-1-pyrrolidin-1-ylpropan-2-amine
CID 54952865
N-[(1R)-1-cycloheptylethyl]heptan-2-amine
CID 81390133
1-methyl-4-propan-2-ylpiperidine;pentane
CID 163403210
1-methyl-N-nonan-2-ylpiperidin-4-amine
CID 43373312
N-(1-cyclopropylethyl)butan-2-amine
CID 43190238
2-methyl-N-[1-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
CID 43307393
N-[1-(1-ethylpiperidin-4-yl)ethyl]octan-4-amine
CID 106023059
N-(1-cyclopropylethyl)undecan-6-amine
CID 43776560
1-(4-chlorophenyl)-N-[1-(1-methylpiperidin-4-yl)ethyl]propan-2-amine
CID 43677582
N-[1-(1-methylpiperidin-4-yl)ethyl]but-3-yn-2-amine
CID 114415483

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine?
The IUPAC name of N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine (CID 62196752) is N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine.
What is the SMILES notation for N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine?
The canonical SMILES for N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine is CCCCC(C)NC(C)C1CCN(C)CC1.
What is the InChIKey of N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine?
The InChIKey is DEDMLJIVMWDVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-6-7-12(2)15-13(3)14-8-10-16(4)11-9-14/h12-15H,5-11H2,1-4H3.
What are the key properties of N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine?
N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methylpiperidin-4-yl)ethyl]hexan-2-amine is sourced from PubChem (CID 62196752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).