7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide

C12H23N3 — CID 162438548

IUPAC7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide
SMILES[H]/N=C(\N)C1CC2(CCN(CCC)CC2)C1
InChIInChI=1S/C12H23N3/c1-2-5-15-6-3-12(4-7-15)8-10(9-12)11(13)14/h10H,2-9H2,1H3,(H3,13,14)
InChIKeyKUBMVHGMVPQZKF-UHFFFAOYSA-N
MW209.34 g/mol
LogP1.82
Rot. Bonds3

About 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide

7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide (PubChem CID 162438548) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide.

Molecular Properties

Compound Name7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide
PubChem CID162438548
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide
SMILES[H]/N=C(\N)C1CC2(CCN(CCC)CC2)C1
InChIInChI=1S/C12H23N3/c1-2-5-15-6-3-12(4-7-15)8-10(9-12)11(13)14/h10H,2-9H2,1H3,(H3,13,14)
InChIKeyKUBMVHGMVPQZKF-UHFFFAOYSA-N
XLogP1.82
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-propyl-7-azaspiro[3.5]nonan-2-amine
CID 146389071
4-propylpiperazine-1-carboximidamide
CID 18176782
ethane;7-propyl-7-azaspiro[3.5]nonane
CID 176563590
4-ethyl-1-propylpiperidin-4-ol
CID 60895499
1-propylpiperidine-4-carboxamide
CID 18678413
4-ethynyl-1-propylpiperidin-4-ol
CID 64915760
4-(4-propylpiperazin-1-yl)butanimidamide
CID 24694384
1-(2-hydroxyethyl)piperidine-4-carboximidamide
CID 144816606
1-heptyl-4-methylpiperidine-4-carboximidamide
CID 107161963
4-methyl-1-nonylpiperidine-4-carboximidamide
CID 107162012
1-decyl-4-methylpiperidine-4-carboximidamide
CID 107162178
2-methyl-3-(4-propylpiperazin-1-yl)propanimidamide
CID 43175069

Frequently Asked Questions

What is the IUPAC name of 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide?
The IUPAC name of 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide (CID 162438548) is 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide.
What is the SMILES notation for 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide?
The canonical SMILES for 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide is [H]/N=C(\N)C1CC2(CCN(CCC)CC2)C1.
What is the InChIKey of 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide?
The InChIKey is KUBMVHGMVPQZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-2-5-15-6-3-12(4-7-15)8-10(9-12)11(13)14/h10H,2-9H2,1H3,(H3,13,14).
What are the key properties of 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide?
7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide has a molecular weight of 209.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propyl-7-azaspiro[3.5]nonane-2-carboximidamide is sourced from PubChem (CID 162438548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).