N-iodo-N,1-dimethylpiperidin-4-amine

C7H15IN2 — CID 134413074

IUPACN-iodo-N,1-dimethylpiperidin-4-amine
SMILESCN1CCC(N(C)I)CC1
InChIInChI=1S/C7H15IN2/c1-9-5-3-7(4-6-9)10(2)8/h7H,3-6H2,1-2H3
InChIKeyJCYVZYRJMHSEHE-UHFFFAOYSA-N
MW254.11 g/mol
LogP1.36
Rot. Bonds1

About N-iodo-N,1-dimethylpiperidin-4-amine

N-iodo-N,1-dimethylpiperidin-4-amine (PubChem CID 134413074) has the molecular formula C7H15IN2 and a molecular weight of 254.11 g/mol. Its IUPAC name is N-iodo-N,1-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-iodo-N,1-dimethylpiperidin-4-amine
PubChem CID134413074
Molecular FormulaC7H15IN2
Molecular Weight254.11 g/mol
Exact Mass254.03
IUPAC NameN-iodo-N,1-dimethylpiperidin-4-amine
SMILESCN1CCC(N(C)I)CC1
InChIInChI=1S/C7H15IN2/c1-9-5-3-7(4-6-9)10(2)8/h7H,3-6H2,1-2H3
InChIKeyJCYVZYRJMHSEHE-UHFFFAOYSA-N
XLogP1.36
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.11
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

4-[iodo(methyl)amino]cyclohexan-1-ol
CID 143163205
(3S)-N,N,1-trimethylpyrrolidin-3-amine
CID 59975379
N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidin-4-amine
CID 59369351
N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane
CID 158426450
N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 169319670
1-methyl-4-[methyl(sulfinato)amino]piperidine
CID 67051302
2-methylbutane;N,N,1-trimethylpiperidin-4-amine
CID 142525400
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]cyclopropanamine
CID 138723132
ethane;N,N,N'-trimethyl-N'-(1-methylpiperidin-4-yl)ethane-1,2-diamine
CID 144721860
1,1-dimethyl-2-(1-methylpiperidin-4-yl)hydrazine
CID 83005655
N-methanidyl-N,1-dimethylpyrrolidin-3-amine
CID 21039801
(4R)-1,4,5-trimethylazepane
CID 89169089

Frequently Asked Questions

What is the IUPAC name of N-iodo-N,1-dimethylpiperidin-4-amine?
The IUPAC name of N-iodo-N,1-dimethylpiperidin-4-amine (CID 134413074) is N-iodo-N,1-dimethylpiperidin-4-amine.
What is the SMILES notation for N-iodo-N,1-dimethylpiperidin-4-amine?
The canonical SMILES for N-iodo-N,1-dimethylpiperidin-4-amine is CN1CCC(N(C)I)CC1.
What is the InChIKey of N-iodo-N,1-dimethylpiperidin-4-amine?
The InChIKey is JCYVZYRJMHSEHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15IN2/c1-9-5-3-7(4-6-9)10(2)8/h7H,3-6H2,1-2H3.
What are the key properties of N-iodo-N,1-dimethylpiperidin-4-amine?
N-iodo-N,1-dimethylpiperidin-4-amine has a molecular weight of 254.11 g/mol, XLogP of 1.36, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-iodo-N,1-dimethylpiperidin-4-amine is sourced from PubChem (CID 134413074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).