(4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine

C9H19N3 — CID 67637542

IUPAC(4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine
SMILESCC1(C)NC(C)(C)C(N)/C1=C\N
InChIInChI=1S/C9H19N3/c1-8(2)6(5-10)7(11)9(3,4)12-8/h5,7,12H,10-11H2,1-4H3/b6-5+
InChIKeyCZRZIMGBFVFWML-AATRIKPKSA-N
MW169.27 g/mol
LogP0.32
Rot. Bonds

About (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine

(4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine (PubChem CID 67637542) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine.

Molecular Properties

Compound Name(4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine
PubChem CID67637542
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC Name(4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine
SMILESCC1(C)NC(C)(C)C(N)/C1=C\N
InChIInChI=1S/C9H19N3/c1-8(2)6(5-10)7(11)9(3,4)12-8/h5,7,12H,10-11H2,1-4H3/b6-5+
InChIKeyCZRZIMGBFVFWML-AATRIKPKSA-N
XLogP0.32
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine?
The IUPAC name of (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine (CID 67637542) is (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine.
What is the SMILES notation for (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine?
The canonical SMILES for (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine is CC1(C)NC(C)(C)C(N)/C1=C\N.
What is the InChIKey of (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine?
The InChIKey is CZRZIMGBFVFWML-AATRIKPKSA-N. The full InChI is InChI=1S/C9H19N3/c1-8(2)6(5-10)7(11)9(3,4)12-8/h5,7,12H,10-11H2,1-4H3/b6-5+.
What are the key properties of (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine?
(4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine has a molecular weight of 169.27 g/mol, XLogP of 0.32, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-4-(aminomethylidene)-2,2,5,5-tetramethylpyrrolidin-3-amine is sourced from PubChem (CID 67637542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).