(4R)-1-iodo-3,3-dimethylpiperidin-4-amine

C7H15IN2 — CID 162525983

IUPAC(4R)-1-iodo-3,3-dimethylpiperidin-4-amine
SMILESCC1(C)CN(I)CC[C@H]1N
InChIInChI=1S/C7H15IN2/c1-7(2)5-10(8)4-3-6(7)9/h6H,3-5,9H2,1-2H3/t6-/m1/s1
InChIKeyYCDKSWJXBPTOJO-ZCFIWIBFSA-N
MW254.11 g/mol
LogP1.40
Rot. Bonds

About (4R)-1-iodo-3,3-dimethylpiperidin-4-amine

(4R)-1-iodo-3,3-dimethylpiperidin-4-amine (PubChem CID 162525983) has the molecular formula C7H15IN2 and a molecular weight of 254.11 g/mol. Its IUPAC name is (4R)-1-iodo-3,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name(4R)-1-iodo-3,3-dimethylpiperidin-4-amine
PubChem CID162525983
Molecular FormulaC7H15IN2
Molecular Weight254.11 g/mol
Exact Mass254.03
IUPAC Name(4R)-1-iodo-3,3-dimethylpiperidin-4-amine
SMILESCC1(C)CN(I)CC[C@H]1N
InChIInChI=1S/C7H15IN2/c1-7(2)5-10(8)4-3-6(7)9/h6H,3-5,9H2,1-2H3/t6-/m1/s1
InChIKeyYCDKSWJXBPTOJO-ZCFIWIBFSA-N
XLogP1.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.11
LogP ≤ 51.40
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of (4R)-1-iodo-3,3-dimethylpiperidin-4-amine?
The IUPAC name of (4R)-1-iodo-3,3-dimethylpiperidin-4-amine (CID 162525983) is (4R)-1-iodo-3,3-dimethylpiperidin-4-amine.
What is the SMILES notation for (4R)-1-iodo-3,3-dimethylpiperidin-4-amine?
The canonical SMILES for (4R)-1-iodo-3,3-dimethylpiperidin-4-amine is CC1(C)CN(I)CC[C@H]1N.
What is the InChIKey of (4R)-1-iodo-3,3-dimethylpiperidin-4-amine?
The InChIKey is YCDKSWJXBPTOJO-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15IN2/c1-7(2)5-10(8)4-3-6(7)9/h6H,3-5,9H2,1-2H3/t6-/m1/s1.
What are the key properties of (4R)-1-iodo-3,3-dimethylpiperidin-4-amine?
(4R)-1-iodo-3,3-dimethylpiperidin-4-amine has a molecular weight of 254.11 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-iodo-3,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 162525983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).