(Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide

C13H26N4 — CID 122468378

IUPAC(Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide
SMILESC/N=C(\N)C(/C(C)=C(/C)N)C1CNCCC1C
InChIInChI=1S/C13H26N4/c1-8-5-6-17-7-11(8)12(13(15)16-4)9(2)10(3)14/h8,11-12,17H,5-7,14H2,1-4H3,(H2,15,16)/b10-9-
InChIKeyUSYNDBMPWHCLNQ-KTKRTIGZSA-N
MW238.38 g/mol
LogP1.09
Rot. Bonds3

About (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide

(Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide (PubChem CID 122468378) has the molecular formula C13H26N4 and a molecular weight of 238.38 g/mol. Its IUPAC name is (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide.

Molecular Properties

Compound Name(Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide
PubChem CID122468378
Molecular FormulaC13H26N4
Molecular Weight238.38 g/mol
Exact Mass238.22
IUPAC Name(Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide
SMILESC/N=C(\N)C(/C(C)=C(/C)N)C1CNCCC1C
InChIInChI=1S/C13H26N4/c1-8-5-6-17-7-11(8)12(13(15)16-4)9(2)10(3)14/h8,11-12,17H,5-7,14H2,1-4H3,(H2,15,16)/b10-9-
InChIKeyUSYNDBMPWHCLNQ-KTKRTIGZSA-N
XLogP1.09
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 51.09
H-Bond Donors ≤ 53
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 (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide?
The IUPAC name of (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide (CID 122468378) is (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide.
What is the SMILES notation for (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide?
The canonical SMILES for (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide is C/N=C(\N)C(/C(C)=C(/C)N)C1CNCCC1C.
What is the InChIKey of (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide?
The InChIKey is USYNDBMPWHCLNQ-KTKRTIGZSA-N. The full InChI is InChI=1S/C13H26N4/c1-8-5-6-17-7-11(8)12(13(15)16-4)9(2)10(3)14/h8,11-12,17H,5-7,14H2,1-4H3,(H2,15,16)/b10-9-.
What are the key properties of (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide?
(Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide has a molecular weight of 238.38 g/mol, XLogP of 1.09, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-amino-N',3-dimethyl-2-(4-methylpiperidin-3-yl)pent-3-enimidamide is sourced from PubChem (CID 122468378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).