5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide

C14H30N4 — CID 65258912

IUPAC5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCN1CCC(N(C)C)CC1
InChIInChI=1S/C14H30N4/c1-14(2,13(15)16)8-5-9-18-10-6-12(7-11-18)17(3)4/h12H,5-11H2,1-4H3,(H3,15,16)
InChIKeyVEKYYWMGUMSNMB-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.75
Rot. Bonds6

About 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide

5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide (PubChem CID 65258912) has the molecular formula C14H30N4 and a molecular weight of 254.42 g/mol. Its IUPAC name is 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide.

Molecular Properties

Compound Name5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide
PubChem CID65258912
Molecular FormulaC14H30N4
Molecular Weight254.42 g/mol
Exact Mass254.25
IUPAC Name5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCN1CCC(N(C)C)CC1
InChIInChI=1S/C14H30N4/c1-14(2,13(15)16)8-5-9-18-10-6-12(7-11-18)17(3)4/h12H,5-11H2,1-4H3,(H3,15,16)
InChIKeyVEKYYWMGUMSNMB-UHFFFAOYSA-N
XLogP1.75
TPSA56.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide?
The IUPAC name of 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide (CID 65258912) is 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide.
What is the SMILES notation for 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide?
The canonical SMILES for 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide is [H]/N=C(\N)C(C)(C)CCCN1CCC(N(C)C)CC1.
What is the InChIKey of 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide?
The InChIKey is VEKYYWMGUMSNMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4/c1-14(2,13(15)16)8-5-9-18-10-6-12(7-11-18)17(3)4/h12H,5-11H2,1-4H3,(H3,15,16).
What are the key properties of 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide?
5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide has a molecular weight of 254.42 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(dimethylamino)piperidin-1-yl]-2,2-dimethylpentanimidamide is sourced from PubChem (CID 65258912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).